WHO基本药物配体 - 小分子和化合物库

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阿比特龙
- ≥99%
CAS号: 154229-19-3

分子式: C₂₄H₃₁NO 分子量: 349.52

IUPAC Name: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol

SMILES: CC12CCC(CC1=CCC3C2CCC4(C3CC=C4C5=CN=CC=C5)C)O

InChIKey: GZOSMCIZMLWJML-VJLLXTKPSA-N

InChI: 1S/C24H31NO/c1-23-11-9-18(26)14-17(23)5-6-19-21-8-7-20(16-4-3-13-25-15-16)24(21,2)12-10-22(19)23/h3-5,7,13,15,18-19,21-22,26H,6,8-12,14H2,1-2H3/t18-,19-,21-,22-,23-,24+/m0/s1
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收藏夹比较
雷尼替丁
- ≥98%
CAS号: 66357-35-5 Compound CID : 3001055

分子式: C₁₃H₂₂N₄O₃S 分子量: 314.39

IUPAC Name: (E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine

SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C

InChIKey: VMXUWOKSQNHOCA-UKTHLTGXSA-N

InChI: 1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
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收藏夹比较
雷尼替丁
- 10mM in DMSO
CAS号: 66357-35-5 Compound CID : 3001055

分子式: C₁₃H₂₂N₄O₃S 分子量: 314.39

IUPAC Name: (E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine

SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CN(C)C

InChIKey: VMXUWOKSQNHOCA-UKTHLTGXSA-N

InChI: 1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+
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