记录说明
(7S,9R,10R)-10-[(2S,4S,5S,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-9-ethyl-4,6,7,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione 收自 NPASS。关联生物包括 Halimeda scabra。
C28H33NO10
式量由分子式和标准同位素质量计算,543.210446。
(7S,9R,10R)-10-[(2S,4S,5S,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-9-ethyl-4,6,7,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione 收自 NPASS。关联生物包括 Halimeda scabra。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
CC[C@]1(C[C@@H](c2c(c(c3c(C(=O)c4c(cccc4O)C3=O)c2O)O)[C@H]1O[C@H]1C[C@@H]([C@@H]([C@H](C)O1)O)N(C)C)O)O
InChIKey
KYKINCMQPGDGSM-DJNFHWKQSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(7S,9R,10R)-10-[(2S,4S,5S,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-9-ethyl-4,6,7,9,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione