 | | A1BHB | | Name: | N-[(8S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl]quinoline-5-carboxamide | | Formula: | C16 H15 N5 O | | SMILES: | O=C(Nc1cnn2CCNCc12)c1cccc2ncccc21 | | InChi: | InChI=1S/C16H15N5O/c22-16(12-3-1-5-13-11(12)4-2-6-18-13)20-14-9-19-21-8-7-17-10-15(14)21/h1-6,9,17H,7-8,10H2,(H,20,22) | | Definition date: | 2024-11-11 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | N-[(8S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl]quinoline-5-carboxamide |
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 | | A1A8O | | Name: | (2S)-2-amino-2-{1-[(5M)-5-(3,5-dichloropyridin-2-yl)isoquinolin-1-yl]piperidin-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one | | Formula: | C25 H27 Cl2 N5 O | | SMILES: | NC(C(=O)N1CCCC1)C1CCN(CC1)c1nccc2c1cccc2c1ncc(Cl)cc1Cl | | InChi: | InChI=1S/C25H27Cl2N5O/c26-17-14-21(27)23(30-15-17)19-4-3-5-20-18(19)6-9-29-24(20)31-12-7-16(8-13-31)22(28)25(33)32-10-1-2-11-32/h3-6,9,14-16,22H,1-2,7-8,10-13,28H2/t22-/m0/s1 | | Definition date: | 2024-09-20 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (2S)-2-amino-2-{1-[(5M)-5-(3,5-dichloropyridin-2-yl)isoquinolin-1-yl]piperidin-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
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 | | A1A9P | | Name: | (2S)-2-amino-2-{1-[7-(4-bromophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidin-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one | | Formula: | C25 H31 Br N6 O | | SMILES: | NC(C(=O)N1CCCC1)C1CCN(CC1)c1ncnc2c1c(C)c(C)n2c1ccc(Br)cc1 | | InChi: | InChI=1S/C25H31BrN6O/c1-16-17(2)32(20-7-5-19(26)6-8-20)24-21(16)23(28-15-29-24)30-13-9-18(10-14-30)22(27)25(33)31-11-3-4-12-31/h5-8,15,18,22H,3-4,9-14,27H2,1-2H3/t22-/m0/s1 | | Definition date: | 2024-09-24 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (2S)-2-amino-2-{1-[7-(4-bromophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidin-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
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 | | A1BU5 | | Name: | (2S,5S)-4-(3,3-difluoro-2,2-dimethylpropanoyl)-2,3,4,5-tetrahydro-2,5-methanopyrido[3,4-f][1,4]oxazepine-9-carbonitrile | | Formula: | C15 H15 F2 N3 O2 | | SMILES: | FC(F)C(C)(C)C(=O)N1CC2CC1c1cncc(C#N)c1O2 | | InChi: | InChI=1S/C15H15F2N3O2/c1-15(2,13(16)17)14(21)20-7-9-3-11(20)10-6-19-5-8(4-18)12(10)22-9/h5-6,9,11,13H,3,7H2,1-2H3/t9-,11-/m0/s1 | | Definition date: | 2025-01-27 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (2S,5S)-4-(3,3-difluoro-2,2-dimethylpropanoyl)-2,3,4,5-tetrahydro-2,5-methanopyrido[3,4-f][1,4]oxazepine-9-carbonitrile |
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 | | A1BVR | | Name: | 5-(5-bromo-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidin]-1'-yl)-3-chloropyridine-2-carbonitrile | | Formula: | C19 H16 Br Cl N4 O | | SMILES: | Clc1cc(cnc1C#N)N1CCC2(CC1)C(=O)N(C)c1ccc(Br)cc12 | | InChi: | InChI=1S/C19H16BrClN4O/c1-24-17-3-2-12(20)8-14(17)19(18(24)26)4-6-25(7-5-19)13-9-15(21)16(10-22)23-11-13/h2-3,8-9,11H,4-7H2,1H3 | | Definition date: | 2025-01-31 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | 5-(5-bromo-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-piperidin]-1'-yl)-3-chloropyridine-2-carbonitrile |
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 | | A1BW1 | | Name: | methyl {[(1S,3s)-3-{[(2P)-2-[(8R)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-5-{[(2S)-2-fluoro-3-hydroxy-3-methylbutyl]carbamoyl}pyridin-4-yl]amino}cyclobutyl]methyl}carbamate | | Formula: | C26 H30 F N7 O4 | | SMILES: | CC(C)(O)C(F)CNC(=O)c1cnc(cc1NC1CC(CNC(=O)OC)C1)c1ccc2cc(cnn12)C#N | | InChi: | InChI=1S/C26H30FN7O4/c1-26(2,37)23(27)14-30-24(35)19-13-29-21(22-5-4-18-8-16(10-28)12-32-34(18)22)9-20(19)33-17-6-15(7-17)11-31-25(36)38-3/h4-5,8-9,12-13,15,17,23,37H,6-7,11,14H2,1-3H3,(H,29,33)(H,30,35)(H,31,36)/t15-,17+,23-/m0/s1 | | Definition date: | 2025-02-14 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | methyl {[(1S,3s)-3-{[(2P)-2-[(8R)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-5-{[(2S)-2-fluoro-3-hydroxy-3-methylbutyl]carbamoyl}pyridin-4-yl]amino}cyclobutyl]methyl}carbamate |
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 | | A1BWZ | | Name: | (6P)-4-{[(1S)-1-cyanoethyl]amino}-6-[(8S)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-N-[(2S)-2-fluoro-3-hydroxy-3-methylbutyl]pyridine-3-carboxamide | | Formula: | C22 H22 F N7 O2 | | SMILES: | CC(C)(O)C(F)CNC(=O)c1cnc(cc1NC(C)C#N)c1ccc2cc(cnn12)C#N | | InChi: | InChI=1S/C22H22FN7O2/c1-13(8-24)29-17-7-18(19-5-4-15-6-14(9-25)10-28-30(15)19)26-11-16(17)21(31)27-12-20(23)22(2,3)32/h4-7,10-11,13,20,32H,12H2,1-3H3,(H,26,29)(H,27,31) | | Definition date: | 2025-02-14 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (6P)-4-{[(1S)-1-cyanoethyl]amino}-6-[(8S)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-N-[(2S)-2-fluoro-3-hydroxy-3-methylbutyl]pyridine-3-carboxamide |
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 | | A1BZK | | Name: | (2R)-2-amino-2-{1-[(5M)-5-(3,5-dichloropyridin-2-yl)isoquinolin-1-yl]piperidin-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one | | Formula: | C25 H27 Cl2 N5 O | | SMILES: | NC(C(=O)N1CCCC1)C1CCN(CC1)c1nccc2c1cccc2c1ncc(Cl)cc1Cl | | InChi: | InChI=1S/C25H27Cl2N5O/c26-17-14-21(27)23(30-15-17)19-4-3-5-20-18(19)6-9-29-24(20)31-12-7-16(8-13-31)22(28)25(33)32-10-1-2-11-32/h3-6,9,14-16,22H,1-2,7-8,10-13,28H2 | | Definition date: | 2025-03-07 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (2R)-2-amino-2-{1-[(5M)-5-(3,5-dichloropyridin-2-yl)isoquinolin-1-yl]piperidin-4-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
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 | | A1CAV | | Name: | (3S)-3-(6-oxo-6,8-dihydro-2H,7H-spiro[furo[2,3-e]isoindole-3,4'-piperidin]-7-yl)piperidine-2,6-dione | | Formula: | C19 H21 N3 O4 | | SMILES: | O=C1NC(=O)CCC1N1Cc2c3OCC4(CCNCC4)c3ccc2C1=O | | InChi: | InChI=1S/C19H21N3O4/c23-15-4-3-14(17(24)21-15)22-9-12-11(18(22)25)1-2-13-16(12)26-10-19(13)5-7-20-8-6-19/h1-2,14,20H,3-10H2,(H,21,23,24)/t14-/m0/s1 | | Definition date: | 2025-04-28 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (3S)-3-(6-oxo-6,8-dihydro-2H,7H-spiro[furo[2,3-e]isoindole-3,4'-piperidin]-7-yl)piperidine-2,6-dione |
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 | | A1CAW | | Name: | (1P)-1-[(4S)-8H-spiro[furo[2,3-c]imidazo[1,2-a]pyridine-7,4'-piperidin]-3-yl]pyrimidine-2,4(1H,3H)-dione | | Formula: | C17 H17 N5 O3 | | SMILES: | O=C1C=CN(C(=O)N1)c1cnc2c3OCC4(CCNCC4)c3ccn12 | | InChi: | InChI=1S/C17H17N5O3/c23-12-2-8-22(16(24)20-12)13-9-19-15-14-11(1-7-21(13)15)17(10-25-14)3-5-18-6-4-17/h1-2,7-9,18H,3-6,10H2,(H,20,23,24) | | Definition date: | 2025-04-28 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (1P)-1-[(4S)-8H-spiro[furo[2,3-c]imidazo[1,2-a]pyridine-7,4'-piperidin]-3-yl]pyrimidine-2,4(1H,3H)-dione |
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 | | A1EKO | | Name: | alpha-L-Glucopyranose | | Formula: | C6 H12 O6 | | SMILES: | OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O | | InChi: | InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m0/s1 | | Synonyms: | alpha-L-glucose | | Definition date: | 2025-01-23 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (2~{R},3~{S},4~{R},5~{R},6~{S})-6-(hydroxymethyl)oxane-2,3,4,5-tetrol |
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 | | A1IBY | | Name: | 3-chloranyl-~{N}-(pyridin-2-ylmethyl)benzamide | | Formula: | C13 H11 Cl N2 O | | SMILES: | Clc1cccc(c1)C(=O)NCc2ccccn2 | | InChi: | InChI=1S/C13H11ClN2O/c14-11-5-3-4-10(8-11)13(17)16-9-12-6-1-2-7-15-12/h1-8H,9H2,(H,16,17) | | Definition date: | 2024-05-20 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | 3-chloranyl-~{N}-(pyridin-2-ylmethyl)benzamide |
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 | | A1IBZ | | Name: | (2~{S})-2-acetamido-~{N}-[(2~{S},3~{R})-1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl]-6-[[(3~{R})-3-(3,4-dichlorophenyl)sulfanylbutanoyl]amino]hexanamide | | Formula: | C22 H32 Cl2 N4 O5 S | | SMILES: | C[CH](O)[CH](NC(=O)[CH](CCCCNC(=O)C[CH](C)Sc1ccc(Cl)c(Cl)c1)NC(C)=O)C(N)=O | | InChi: | InChI=1S/C22H32Cl2N4O5S/c1-12(34-15-7-8-16(23)17(24)11-15)10-19(31)26-9-5-4-6-18(27-14(3)30)22(33)28-20(13(2)29)21(25)32/h7-8,11-13,18,20,29H,4-6,9-10H2,1-3H3,(H2,25,32)(H,26,31)(H,27,30)(H,28,33)/t12-,13-,18+,20+/m1/s1 | | Definition date: | 2024-05-20 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (2~{S})-2-acetamido-~{N}-[(2~{S},3~{R})-1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl]-6-[[(3~{R})-3-(3,4-dichlorophenyl)sulfanylbutanoyl]amino]hexanamide |
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 | | A1IJH | | Name: | Tungstopterin cofactor | | Formula: | C20 H22 Mg N10 O12 P2 S4 W | | SMILES: | NC1=NC2=C(N[CH]3[CH](N2)O[CH]4CO[P](O)(=O)O[Mg]O[P](O)(=O)OC[CH]5O[CH]6NC7=C(N[CH]6C8=C5S[W]9(SC4=C3S9)S8)C(=O)NC(=N7)N)C(=O)N1 | | InChi: | InChI=1S/2C10H14N5O6PS2.Mg.W/c2*11-10-14-7-4(8(16)15-10)12-3-6(24)5(23)2(21-9(3)13-7)1-20-22(17,18)19 | | Definition date: | 2024-07-31 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 |
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 | | A1IPF | | Name: | (3~{a}~{S},8~{a}~{R})-2-[8,8-bis(chloranyl)-7-propan-2-yl-7$l^{3}-oxa-8$l^{5}-ruthenabicyclo[4.3.0]nona-1(6),2,4-trien-8-yl]-1,3-bis(2,4,6-trimethylphenyl)-3~{a},7,8,8~{a}-tetrahydroimidazo[4,5-d][1,2,7]thiadiazepine 6,6-dioxide | | Formula: | C33 H44 Cl2 N4 O3 Ru S | | SMILES: | CC(C)[O+]1c2ccccc2C[Ru]1(Cl)(Cl)C3N([CH]4CN[S](=O)(=O)NC[CH]4N3c5c(C)cc(C)cc5C)c6c(C)cc(C)cc6C | | InChi: | InChI=1S/C23H31N4O2S.C10H13O.2ClH.Ru/c1-14-7-16(3)22(17(4)8-14)26-13-27(23-18(5)9-15(2)10-19(23)6)21-12-25-30(28,29)24-11-20(21)26 | | Definition date: | 2024-09-23 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (3~{a}~{R},8~{a}~{R})-2-[8,8-bis(chloranyl)-7-propan-2-yl-7-oxonia-8$l^{5}-ruthenabicyclo[4.3.0]nona-1(6),2,4-trien-8-yl]-1,3-bis(2,4,6-trimethylphenyl)-3~{a},4,5,7,8,8~{a}-hexahydro-2~{H}-imidazo[4,5-d][1,2,7]thiadiazepine 6,6-dioxide |
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 | | A1IUV | | Name: | 6-[2-(dimethylamino)ethylamino]-3-oxidanyl-indeno[2,1-c]quinolin-7-one | | Formula: | C20 H19 N3 O2 | | SMILES: | CN(C)CCNc1nc2cc(O)ccc2c3c4ccccc4C(=O)c13 | | InChi: | InChI=1S/C20H19N3O2/c1-23(2)10-9-21-20-18-17(13-5-3-4-6-14(13)19(18)25)15-8-7-12(24)11-16(15)22-20/h3-8,11,24H,9-10H2,1-2H3,(H,21,22) | | Definition date: | 2024-11-21 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | 6-[2-(dimethylamino)ethylamino]-3-oxidanyl-indeno[2,1-c]quinolin-7-one |
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 | | A1IVB | | Name: | [(2~{R},3~{S},4~{R},5~{R})-5-(6-azanyl-8-butylsulfanyl-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate | | Formula: | C14 H22 N5 O7 P S | | SMILES: | CCCCSc1nc2c(N)ncnc2n1[CH]3O[CH](CO[P](O)(O)=O)[CH](O)[CH]3O | | InChi: | InChI=1S/C14H22N5O7PS/c1-2-3-4-28-14-18-8-11(15)16-6-17-12(8)19(14)13-10(21)9(20)7(26-13)5-25-27(22,23)24/h6-7,9-10,13,20-21H,2-5H2,1H3,(H2,15,16,17)(H2,22,23,24)/t7-,9-,10-,13-/m1/s1 | | Definition date: | 2024-11-28 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | [(2~{R},3~{S},4~{R},5~{R})-5-(6-azanyl-8-butylsulfanyl-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate |
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 | | A1IVH | | Name: | [5-[2-chloranyl-6-[methyl-(phenylmethyl)amino]purin-9-yl]pentoxy-oxidanyl-phosphoryl]methylphosphonic acid | | Formula: | C19 H26 Cl N5 O6 P2 | | SMILES: | CN(Cc1ccccc1)c2nc(Cl)nc3n(CCCCCO[P](O)(=O)C[P](O)(O)=O)cnc23 | | InChi: | InChI=1S/C19H26ClN5O6P2/c1-24(12-15-8-4-2-5-9-15)17-16-18(23-19(20)22-17)25(13-21-16)10-6-3-7-11-31-33(29,30)14-32(26,27)28/h2,4-5,8-9,13H,3,6-7,10-12,14H2,1H3,(H,29,30)(H2,26,27,28) | | Definition date: | 2024-11-29 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | [5-[2-chloranyl-6-[methyl-(phenylmethyl)amino]purin-9-yl]pentoxy-oxidanyl-phosphoryl]methylphosphonic acid |
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 | | A1JAF | | Name: | 3-[(1,3-dimethylpyrazol-4-yl)amino]-5-(methylamino)-6-(3-methylimidazo[4,5-c]pyridin-7-yl)pyrazine-2-carboxamide | | Formula: | C18 H20 N10 O | | SMILES: | CNc1nc(Nc2cn(C)nc2C)c(nc1c3cncc4n(C)cnc34)C(N)=O | | InChi: | InChI=1S/C18H20N10O/c1-9-11(7-28(4)26-9)23-18-15(16(19)29)24-14(17(20-2)25-18)10-5-21-6-12-13(10)22-8-27(12)3/h5-8H,1-4H3,(H2,19,29)(H2,20,23,25) | | Definition date: | 2025-04-08 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | 3-[(1,3-dimethylpyrazol-4-yl)amino]-5-(methylamino)-6-(3-methylimidazo[4,5-c]pyridin-7-yl)pyrazine-2-carboxamide |
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 | | A1L4H | | Name: | 4-[3-(hydroxymethyl)phenoxy]-~{N}-methyl-~{N}-[3-methyl-4-[[(3~{S})-3-methylpiperazin-1-yl]methyl]phenyl]cyclohexane-1-carboxamide | | Formula: | C28 H39 N3 O3 | | SMILES: | C[CH]1CN(CCN1)Cc2ccc(cc2C)N(C)C(=O)[CH]3CC[CH](CC3)Oc4cccc(CO)c4 | | InChi: | InChI=1S/C28H39N3O3/c1-20-15-25(10-7-24(20)18-31-14-13-29-21(2)17-31)30(3)28(33)23-8-11-26(12-9-23)34-27-6-4-5-22(16-27)19-32/h4-7,10,15-16,21,23,26,29,32H,8-9,11-14,17-19H2,1-3H3/t21-,23-,26-/m0/s1 | | Synonyms: | DS-3801b | | Definition date: | 2024-10-01 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | 4-[3-(hydroxymethyl)phenoxy]-~{N}-methyl-~{N}-[3-methyl-4-[[(3~{S})-3-methylpiperazin-1-yl]methyl]phenyl]cyclohexane-1-carboxamide |
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 | | U6L | | Name: | (1~{R})-1-(3-ethylphenyl)ethane-1,2-diol | | Formula: | C10 H14 O2 | | SMILES: | CCc1cccc(c1)[CH](O)CO | | InChi: | InChI=1S/C10H14O2/c1-2-8-4-3-5-9(6-8)10(12)7-11/h3-6,10-12H,2,7H2,1H3/t10-/m0/s1 | | Synonyms: | SCHEMBL24015313 | | Definition date: | 2023-09-05 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (1~{R})-1-(3-ethylphenyl)ethane-1,2-diol |
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 | | ZWB | | Name: | (3~{R})-3-[(1~{S})-2-[(1~{R},3~{S},4~{a}~{S},7~{S},8~{a}~{S})-7-bromanyl-5,5,8~{a}-trimethyl-2-methylidene-3-oxidanyl-3,4,4~{a},6,7,8-hexahydro-1~{H}-naphthalen-1-yl]-1-oxidanyl-ethyl]pyrrolidine-2,5-dione | | Formula: | C20 H30 Br N O4 | | SMILES: | CC1(C)C[CH](Br)C[C]2(C)[CH](C[CH](O)[CH]3CC(=O)NC3=O)C(=C)[CH](O)C[CH]12 | | InChi: | InChI=1S/C20H30BrNO4/c1-10-13(6-15(24)12-5-17(25)22-18(12)26)20(4)9-11(21)8-19(2,3)16(20)7-14(10)23/h11-16,23-24H,1,5-9H2,2-4H3,(H,22,25,26)/t11-,12+,13-,14-,15-,16-,20+/m0/s1 | | Definition date: | 2023-07-05 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (3~{R})-3-[(1~{S})-2-[(1~{R},3~{S},4~{a}~{S},7~{S},8~{a}~{S})-7-bromanyl-5,5,8~{a}-trimethyl-2-methylidene-3-oxidanyl-3,4,4~{a},6,7,8-hexahydro-1~{H}-naphthalen-1-yl]-1-oxidanyl-ethyl]pyrrolidine-2,5-dione |
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 | | A1BWY | | Name: | (6P)-6-[(8R)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-4-({(1s,4S)-4-[1-(difluoromethyl)-1H-pyrazol-4-yl]cyclohexyl}amino)-N-[(2S)-2-fluoro-3-hydroxy-3-methylbutyl]pyridine-3-carboxamide | | Formula: | C29 H31 F3 N8 O2 | | SMILES: | FC(F)n1cc(cn1)C1CCC(Nc2cc(ncc2C(=O)NCC(F)C(C)(C)O)c2ccc3cc(C#N)cnn32)CC1 | | InChi: | InChI=1S/C29H31F3N8O2/c1-29(2,42)26(30)15-35-27(41)22-14-34-24(25-8-7-21-9-17(11-33)12-37-40(21)25)10-23(22)38-20-5-3-18(4-6-20)19-13-36-39(16-19)28(31)32/h7-10,12-14,16,18,20,26,28,42H,3-6,15H2,1-2H3,(H,34,38)(H,35,41)/t18-,20+,26-/m0/s1 | | Definition date: | 2025-02-14 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (6P)-6-[(8R)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-4-({(1s,4S)-4-[1-(difluoromethyl)-1H-pyrazol-4-yl]cyclohexyl}amino)-N-[(2S)-2-fluoro-3-hydroxy-3-methylbutyl]pyridine-3-carboxamide |
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 | | A1L1Z | | Name: | Herbacetin | | Formula: | C15 H10 O7 | | SMILES: | Oc1ccc(cc1)C2=C(O)C(=O)c3c(O)cc(O)c(O)c3O2 | | InChi: | InChI=1S/C15H10O7/c16-7-3-1-6(2-4-7)14-13(21)12(20)10-8(17)5-9(18)11(19)15(10)22-14/h1-5,16-19,21H | | Synonyms: | 2-(4-hydroxyphenyl)-3,5,7,8-tetrakis(oxidanyl)chromen-4-one | | Definition date: | 2024-05-23 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | 2-(4-hydroxyphenyl)-3,5,7,8-tetrakis(oxidanyl)chromen-4-one |
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 | | A1L3F | | Name: | (5-chloranylpyridin-2-yl)methanamine | | Formula: | C6 H7 Cl N2 | | SMILES: | NCc1ccc(Cl)cn1 | | InChi: | InChI=1S/C6H7ClN2/c7-5-1-2-6(3-8)9-4-5/h1-2,4H,3,8H2 | | Definition date: | 2024-08-02 | | Last modified: | 2025-05-23 | | Release date: | 2025-05-28 | | Identifier: | (5-chloranylpyridin-2-yl)methanamine |
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