3'-Geranyl-3-prenyl-2',4',5,7-tetrahydroxyflavone
HIT212665166
sdf文件结构编辑类似物检索
HIT ID: HIT212665166
Cas No: 1334309-44-2
分子式: C30H34O6
分子量: 490.596
常用名: 3'-Geranyl-3-prenyl-2',4',5,7-tetrahydroxyflavone
常用名: 3'-Geranyl-3-prenyl-2',4',5,7-tetrahydroxyflavone
氢键受体数 (HBA): 6
氢键供体数 (HBD): 4
LogP: 7.402101
IUPAC: 2-{3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-5,7-dihydroxy-3-(3-methylbut-2-en-1-yl)-4H-chromen-4-one
IUPAC: 2-{3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-5,7-dihydroxy-3-(3-methylbut-2-en-1-yl)-4H-chromen-4-one
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(c1-[#8])-c1oc2cc(-[#8])cc(-[#8])c2c(=O)c1-[#6]\[#6]=[#6](\[#6])-[#6]
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(c1-[#8])-c1oc2cc(-[#8])cc(-[#8])c2c(=O)c1-[#6]\[#6]=[#6](\[#6])-[#6]
InChI key: GLWAWFMOTOFEGT-VXLYETTFSA-N
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