WHO基本药物配体 - 小分子和化合物库

收藏夹比较
卡比多巴
- ≥98%
CAS号 : 28860-95-9 Compound CID : 34359

分子式: C₁₀H₁₄N₂O₄ 分子量: 226.23

IUPAC Name: (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid

SMILES: CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)NN

InChIKey: TZFNLOMSOLWIDK-JTQLQIEISA-N

InChI: InChI=1S/C10H14N2O4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6/h2-4,12-14H,5,11H2,1H3,(H,15,16)/t10-/m0/s1
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收藏夹比较
依帕列净 (BI 10773)
- ≥99%
CAS号 : 864070-44-0 Compound CID : 11949646

分子式: C₂₃H₂₇ClO₇ 分子量: 450.91

IUPAC Name: (2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

SMILES: C1COCC1OC2=CC=C(C=C2)CC3=C(C=CC(=C3)C4C(C(C(C(O4)CO)O)O)O)Cl

InChIKey: OBWASQILIWPZMG-QZMOQZSNSA-N

InChI: InChI=1S/C23H27ClO7/c24-18-6-3-14(23-22(28)21(27)20(26)19(11-25)31-23)10-15(18)9-13-1-4-16(5-2-13)30-17-7-8-29-12-17/h1-6,10,17,19-23,25-28H,7-9,11-12H2/t17-,19+,20+,21-,22+,23-/m0/s1
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