Amorfrutin 4
HIT106146282
sdf文件结构编辑类似物检索
HIT ID: HIT106146282
Cas No: 73436-04-1
分子式: C25H30O4
分子量: 394.511
常用名: Amorfrutin 4
氢键受体数 (HBA): 4
氢键供体数 (HBD): 3
LogP: 7.598
IUPAC: 3-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxy-6-(2-phenylethyl)benzoic acid
IUPAC: 3-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxy-6-(2-phenylethyl)benzoic acid
SMILES: [#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])cc(-[#6]-[#6]-c2ccccc2)c(-[#6](-[#8])=O)c1-[#8]
SMILES: [#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])cc(-[#6]-[#6]-c2ccccc2)c(-[#6](-[#8])=O)c1-[#8]
InChI key: UAMAHWUELDAAIA-PDGQHHTCSA-N
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