Clusiacyclol A
HIT100526551
sdf文件结构编辑类似物检索
HIT ID: HIT100526551
Cas No: ng;163597-69-1
分子式: C23H24O4
分子量: 364.441
常用名: Clusiacyclol A
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 5.826
IUPAC: 4-benzoyl-9,13,13-trimethyl-8-oxatetracyclo[7.4.1.0^{2,7}.0^{12,14}]tetradeca-2(7),3,5-triene-3,5-diol
IUPAC: 4-benzoyl-9,13,13-trimethyl-8-oxatetracyclo[7.4.1.0^{2,7}.0^{12,14}]tetradeca-2(7),3,5-triene-3,5-diol
SMILES: CC1(C)C2CCC3(C)Oc4cc(O)c(C(=O)c5ccccc5)c(O)c4C1C23
SMILES: CC1(C)C2CCC3(C)Oc4cc(O)c(C(=O)c5ccccc5)c(O)c4C1C23
InChI key: BQIVXBUAUNSLAJ-UHFFFAOYSA-N
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