Arisugacin E
HIT219251529
sdf文件结构编辑类似物检索
HIT ID: HIT219251529
Cas No: 261951-22-8
分子式: C27H34O6
分子量: 454.563
常用名: Arisugacin E
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (5aR,7aS,9R,11aR,11bR)-7a,9-dihydroxy-3-(4-methoxyphenyl)-5a,8,8,11a-tetramethyl-1,5a,6,7,7a,8,9,10,11,11a,11b,12-dodecahydro-2,5-dioxatetraphen-1-one
IUPAC: (5aR,7aS,9R,11aR,11bR)-7a,9-dihydroxy-3-(4-methoxyphenyl)-5a,8,8,11a-tetramethyl-1,5a,6,7,7a,8,9,10,11,11a,11b,12-dodecahydro-2,5-dioxatetraphen-1-one
SMILES: [H][C@]12Cc3c(O[C@]1(C)CC[C@@]1(O)C(C)(C)[C@H](O)CC[C@]21C)cc(oc3=O)-c1ccc(OC)cc1
SMILES: [H][C@]12Cc3c(O[C@]1(C)CC[C@@]1(O)C(C)(C)[C@H](O)CC[C@]21C)cc(oc3=O)-c1ccc(OC)cc1
InChI key: GECAUTUYQKKNPV-XIVUVDIESA-N
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