Sarothralin G
HIT218887524
sdf文件结构编辑类似物检索
HIT ID: HIT218887524
Cas No: 130756-15-9
分子式: C36H42O8
分子量: 602.724
常用名: Sarothralin G
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-({3-benzoyl-5-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-2,4,6-trihydroxyphenyl}methyl)-3,5-dihydroxy-4,4-dimethyl-6-(2-methylpropanoyl)cyclohexa-2,5-dien-1-one
IUPAC: 2-({3-benzoyl-5-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-2,4,6-trihydroxyphenyl}methyl)-3,5-dihydroxy-4,4-dimethyl-6-(2-methylpropanoyl)cyclohexa-2,5-dien-1-one
SMILES: CC(C)C(=O)C1=C(O)C(C)(C)C(O)=C(Cc2c(O)c(C\C=C(/C)CCC=C(C)C)c(O)c(C(=O)c3ccccc3)c2O)C1=O
SMILES: CC(C)C(=O)C1=C(O)C(C)(C)C(O)=C(Cc2c(O)c(C\C=C(/C)CCC=C(C)C)c(O)c(C(=O)c3ccccc3)c2O)C1=O
InChI key: SGRCMCINDHFZMR-LTGZKZEYSA-N
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