7-O-Ethylepirosmanol
HIT218852564
sdf文件结构编辑类似物检索
HIT ID: HIT218852564
Cas No: 1394242-96-6
分子式: C22H30O5
分子量: 374.477
常用名: 7-O-Ethylepirosmanol
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (8R,9S,10S)-8-ethoxy-3,4-dihydroxy-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo[7.5.2.0^{1,10}.0^{2,7}]hexadeca-2(7),3,5-trien-15-one
IUPAC: (8R,9S,10S)-8-ethoxy-3,4-dihydroxy-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo[7.5.2.0^{1,10}.0^{2,7}]hexadeca-2(7),3,5-trien-15-one
SMILES: [H][C@]12OC(=O)C3(CCCC(C)(C)[C@]13[H])c1c(O)c(O)c(cc1[C@H]2OCC)C(C)C
SMILES: [H][C@]12OC(=O)C3(CCCC(C)(C)[C@]13[H])c1c(O)c(O)c(cc1[C@H]2OCC)C(C)C
InChI key: HEUIVINVBVPWCU-AGQFNQOXSA-N
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