2,11,12-Trihydroxy-7,20-epoxy-8,11,13-abietatriene
HIT214312658
sdf文件结构编辑类似物检索
HIT ID: HIT214312658
Cas No: 1608462-12-9
分子式: C20H28O4
分子量: 332.44
常用名: 2,11,12-Trihydroxy-7,20-epoxy-8,11,13-abietatriene
常用名: 2,11,12-Trihydroxy-7,20-epoxy-8,11,13-abietatriene
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,8S,10S,13S)-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo[6.6.2.0^{1,10}.0^{2,7}]hexadeca-2(7),3,5-triene-3,4,13-triol
IUPAC: (1R,8S,10S,13S)-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo[6.6.2.0^{1,10}.0^{2,7}]hexadeca-2(7),3,5-triene-3,4,13-triol
SMILES: CC(C)c1cc2[C@@H]3C[C@H]4C(C)(C)C[C@H](O)C[C@]4(CO3)c2c(O)c1O |TLB:9:8:18.17:5.19|
SMILES: CC(C)c1cc2[C@@H]3C[C@H]4C(C)(C)C[C@H](O)C[C@]4(CO3)c2c(O)c1O |TLB:9:8:18.17:5.19|
InChI key: KRVFRLOLTQRXBW-MRQYSOIQSA-N
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