Methyl 3-O-feruloylquinate
HIT213885943
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HIT ID: HIT213885943
Cas No: 154418-15-2
分子式: C18H22O9
分子量: 382.365
常用名: Methyl 3-O-feruloylquinate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methyl (1S,3R,4R,5R)-1,3,4-trihydroxy-5-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylate
IUPAC: methyl (1S,3R,4R,5R)-1,3,4-trihydroxy-5-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylate
SMILES: COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(OC)c1
SMILES: COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(OC)c1
InChI key: CPYDMLXRLHYXSV-JVCGYDKASA-N
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