记录说明
(1R,35R,37R,38S,39S)-6,7,8,11,12,23,24,27,28,29,37,38,39-tridecahydroxy-2,14,21,33,36-pentaoxaoctacyclo[33.2.2.04,9.010,19.013,18.016,25.017,22.026,31]nonatriaconta-4,6,8,10,12,16, 收自 NPASS。关联生物包括 Oscillatoria princeps。
C34H22O22
式量由分子式和标准同位素质量计算,782.060272。
(1R,35R,37R,38S,39S)-6,7,8,11,12,23,24,27,28,29,37,38,39-tridecahydroxy-2,14,21,33,36-pentaoxaoctacyclo[33.2.2.04,9.010,19.013,18.016,25.017,22.026,31]nonatriaconta-4,6,8,10,12,16, 收自 NPASS。关联生物包括 Oscillatoria princeps。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
c1c2c(-c3c4c5c6c(c(-c7c(cc(c(c7O)O)O)C(=O)O[C@@H]7[C@H]([C@@H]([C@@H](COC2=O)O[C@H]7O)O)O)c(c(c6oc4=O)O)O)c(=O)oc5c(c3O)O)c(c(c1O)O)O
InChIKey
UYUWZEVALXYVNM-MGMQMRNLSA-N
CAS:这里用的两张来源表里没有。
IUPAC
(1R,35R,37R,38S,39S)-6,7,8,11,12,23,24,27,28,29,37,38,39-tridecahydroxy-2,14,21,33,36-pentaoxaoctacyclo[33.2.2.04,9.010,19.013,18.016,25.017,22.026,31]nonatriaconta-4,6,8,10,12,16,18,22,24,26,28,30-dodecaene-3,15,20,32-tetrone