HIT ID: HIT212665412
Cas No: 115063-39-3
分子式: C20H20O5
分子量: 340.375
常用名: Desmethylxanthohumol
氢键受体数 (HBA): 5
氢键供体数 (HBD): 4
LogP: 5.704631
IUPAC: (2E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one
IUPAC: (2E)-3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])c(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c1-[#8]
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])c(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c1-[#8]
InChI key: FUSADYLVRMROPL-UXBLZVDNSA-N
