记录说明
[(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate 收自 NPASS。关联生物包括 Schizymenia dubyi。
C34H56O4
式量由分子式和标准同位素质量计算,528.417860。
[(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate 收自 NPASS。关联生物包括 Schizymenia dubyi。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)[C@H]2CC[C@H]2[C@]4(C)CCC(C)(C)[C@@H]([C@H]4CC[C@]32C)OC(=O)C)C1(C)C
InChIKey
CLQNVQHFNHHVRX-IWOPKFDISA-N
CAS:这里用的两张来源表里没有。
IUPAC
[(3S,4aR,6aS,6aS,6bS,8aS,9R,12aS,14aS,14bR)-9-acetyloxy-4,4,6a,6b,10,10,12a,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,8a,9,11,12,13,14,14a-hexadecahydropicen-3-yl] acetate