Steganacin
HIT107407869
sdf文件结构编辑类似物检索
HIT ID: HIT107407869
Cas No: 41451-68-7
分子式: C24H24O9
分子量: 456.447
常用名: Steganacin
氢键受体数 (HBA): 7
氢键供体数 (HBD): 0
LogP: 2.29
IUPAC: (9R,13R,14R)-3,4,5-trimethoxy-10-oxo-11,18,20-trioxapentacyclo[13.7.0.0^{2,7}.0^{9,13}.0^{17,21}]docosa-1(15),2(7),3,5,16,21-hexaen-14-yl acetate
IUPAC: (9R,13R,14R)-3,4,5-trimethoxy-10-oxo-11,18,20-trioxapentacyclo[13.7.0.0^{2,7}.0^{9,13}.0^{17,21}]docosa-1(15),2(7),3,5,16,21-hexaen-14-yl acetate
SMILES: COc1cc2C[C@@H]3[C@H](COC3=O)[C@@H](OC(C)=O)c3cc4OCOc4cc3-c2c(OC)c1OC
SMILES: COc1cc2C[C@@H]3[C@H](COC3=O)[C@@H](OC(C)=O)c3cc4OCOc4cc3-c2c(OC)c1OC
InChI key: XJTXBUKLGQCZHC-XFQAVAEZSA-N
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