HIT ID: HIT212525328
Cas No: 1217271-08-3
分子式: C13H20O3
分子量: 224.3
常用名: 1,2-Dinor-3-oxo-6,10-farnesadien-14-oic acid; Z-Fo
常用名: 1,2-Dinor-3-oxo-6,10-farnesadien-14-oic acid; Z-Fo
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 2.873
IUPAC: (2Z)-2-(4-methylpent-3-en-1-yl)-6-oxohept-2-enoic acid
IUPAC: (2Z)-2-(4-methylpent-3-en-1-yl)-6-oxohept-2-enoic acid
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](=[#6]\[#6]-[#6]-[#6](-[#6])=O)-[#6](-[#8])=O
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](=[#6]\[#6]-[#6]-[#6](-[#6])=O)-[#6](-[#8])=O
InChI key: QJLQJNOTGYJCQZ-XFXZXTDPSA-N
