HIT ID: HIT103336266
Cas No: 31524-62-6
分子式: C20H20O4
分子量: 324.376
常用名: Isobavachin
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 4.217
IUPAC: (2S)-7-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC: (2S)-7-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-4-one
SMILES: [#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])ccc2-[#6](=O)-[#6]-[#6@H](-[#8]-c12)-c1ccc(-[#8])cc1
SMILES: [#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])ccc2-[#6](=O)-[#6]-[#6@H](-[#8]-c12)-c1ccc(-[#8])cc1
InChI key: KYFBXCHUXFKMGQ-IBGZPJMESA-N
