记录说明
[(2S,3S,4S)-2-[(3R,4aR,6aR,12S,12aS,12bR)-12-hydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-8,11-dioxo-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]-4-methylhexan-3-yl] 收自 NPASS。关联生物包括 Arthrospira platensis。
C30H44O8
式量由分子式和标准同位素质量计算,532.303618。
[(2S,3S,4S)-2-[(3R,4aR,6aR,12S,12aS,12bR)-12-hydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-8,11-dioxo-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]-4-methylhexan-3-yl] 收自 NPASS。关联生物包括 Arthrospira platensis。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CC[C@H](C)[C@@H]([C@@H](C)C1=CC(=O)C2=C(C1=O)O[C@]1(C)CC[C@@H]3[C@](C)(CC[C@H](C(C)(C)O)O3)[C@H]1[C@@H]2O)OC(=O)C
InChIKey
UWSYUCZPPVXEKW-DDDVLVPESA-N
CAS:这里用的两张来源表里没有。
IUPAC
[(2S,3S,4S)-2-[(3R,4aR,6aR,12S,12aS,12bR)-12-hydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-8,11-dioxo-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-9-yl]-4-methylhexan-3-yl] acetate