Awamycin
HIT218887214
sdf文件结构编辑类似物检索
HIT ID: HIT218887214
Cas No: 87913-35-7
分子式: C38H49NO12S
分子量: 743.87
常用名: Awamycin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methyl 2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.0^{5,27}]octacosa-1,3,5(27),7,18,20,24-heptaene-13-carboxylate
IUPAC: methyl 2,10,12,14,16-pentahydroxy-4-methoxy-3,7,9,11,15,17,21-heptamethyl-25-(methylsulfanyl)-6,22,26,28-tetraoxo-23-azatricyclo[22.3.1.0^{5,27}]octacosa-1,3,5(27),7,18,20,24-heptaene-13-carboxylate
SMILES: COC(=O)C1C(O)C(C)C(O)C(C)C=CC=C(C)C(=O)NC2=C(SC)C(=O)c3c(C2=O)c(O)c(C)c(OC)c3C(=O)C(C)=CC(C)C(O)C(C)C1O
SMILES: COC(=O)C1C(O)C(C)C(O)C(C)C=CC=C(C)C(=O)NC2=C(SC)C(=O)c3c(C2=O)c(O)c(C)c(OC)c3C(=O)C(C)=CC(C)C(O)C(C)C1O
InChI key: WZCNXFSCUFEMGW-UHFFFAOYSA-N
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