NSC 30555
HIT212717502
sdf文件结构编辑类似物检索
HIT ID: HIT212717502
Cas No: 6219-66-5
分子式: C20H14O10
分子量: 414.322
常用名: NSC 30555
氢键受体数 (HBA): 10
氢键供体数 (HBD): 5
LogP: 4.4388137
IUPAC: 7-acetyl-6-ethyl-3,5,8-trihydroxy-9,10-dioxo-9,10-dihydroanthracene-1,2-dicarboxylic acid
IUPAC: 7-acetyl-6-ethyl-3,5,8-trihydroxy-9,10-dioxo-9,10-dihydroanthracene-1,2-dicarboxylic acid
SMILES: CCc1c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c(O)c1C(C)=O
SMILES: CCc1c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c(O)c1C(C)=O
InChI key: RHAXKFFKGZJUOE-UHFFFAOYSA-N
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