HIT ID: HIT100933296
Cas No: 80489-90-3
分子式: C21H24O4
分子量: 340.419
常用名: Amorfrutin A
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 6.085
IUPAC: 2-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)-6-(2-phenylethyl)benzoic acid
IUPAC: 2-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)-6-(2-phenylethyl)benzoic acid
SMILES: [#6]-[#8]-c1cc(-[#6]-[#6]-c2ccccc2)c(-[#6](-[#8])=O)c(-[#8])c1-[#6]\[#6]=[#6](/[#6])-[#6]
SMILES: [#6]-[#8]-c1cc(-[#6]-[#6]-c2ccccc2)c(-[#6](-[#8])=O)c(-[#8])c1-[#6]\[#6]=[#6](/[#6])-[#6]
InChI key: CTNFTPUIYFUXBE-UHFFFAOYSA-N
