ES-242-4
HIT100231395
sdf文件结构编辑类似物检索
HIT ID: HIT100231395
Cas No: 136565-69-0
分子式: C32H34O10
分子量: 578.614
常用名: ES-242-4
氢键受体数 (HBA): 10
氢键供体数 (HBD): 4
LogP: 3.188
IUPAC: (3S,4S)-5-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-5-yl]-7,9-dimethoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-4,10-diol
IUPAC: (3S,4S)-5-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-5-yl]-7,9-dimethoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-4,10-diol
SMILES: COc1cc(OC)c2c(O)c3CO[C@@H](C)[C@@H](O)c3c(-c3c4[C@H](O)[C@H](C)OCc4c(O)c4c(OC)cc(OC)cc34)c2c1
SMILES: COc1cc(OC)c2c(O)c3CO[C@@H](C)[C@@H](O)c3c(-c3c4[C@H](O)[C@H](C)OCc4c(O)c4c(OC)cc(OC)cc34)c2c1
InChI key: AVAQRWVGWWNBIN-CUAUGLLKSA-N
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