Isodihydroauroglaucin
HIT212523848
sdf文件结构编辑类似物检索
HIT ID: HIT212523848
Cas No: 74886-31-0
分子式: C19H24O3
分子量: 300.398
常用名: Isodihydroauroglaucin
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: 5.914
IUPAC: 2-[(3E,5E)-hepta-3,5-dien-1-yl]-3,6-dihydroxy-5-(3-methylbut-2-en-1-yl)benzaldehyde
IUPAC: 2-[(3E,5E)-hepta-3,5-dien-1-yl]-3,6-dihydroxy-5-(3-methylbut-2-en-1-yl)benzaldehyde
SMILES: [#6]\[#6]=[#6]\[#6]=[#6]\[#6]-[#6]-c1c(-[#8])cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c1-[#6]=O
SMILES: [#6]\[#6]=[#6]\[#6]=[#6]\[#6]-[#6]-c1c(-[#8])cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c1-[#6]=O
InChI key: ZNSOEVHEUKFQSM-YTXTXJHMSA-N
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