记录说明
[(3R,8R,9S,10R,13R,14R,16S,17S)-17-acetyl-3-[(2S,3S,4R,5R,6S)-5-[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4-h 收自 NPASS。关联生物包括 Laurencia hybrida。
C57H92O27
式量由分子式和标准同位素质量计算,1208.582598。
[(3R,8R,9S,10R,13R,14R,16S,17S)-17-acetyl-3-[(2S,3S,4R,5R,6S)-5-[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4-h 收自 NPASS。关联生物包括 Laurencia hybrida。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C[C@H](CCC(=O)O[C@H]1C[C@@H]2[C@H]3CC=C4C[C@@H](CC[C@]4(C)[C@H]3CC[C@@]2(C)[C@@H]1C(=O)C)O[C@@H]1[C@H]([C@@H]([C@H]([C@H](CO)O1)O[C@@H]1[C@H]([C@@H]([C@H]([C@H](C)O1)O[C@@H]1[C@H]([C@@H]([C@H]([C@H](C)O1)O)O)O)O)O)O)O[C@@H]1[C@H]([C@@H]([C@H]([C@H](C)O1)O)O)O)CO[C@@H]1[C@H]([C@@H]([C@H]([C@H](CO)O1)O)O)O
InChIKey
QSKFJIQOEAWAJW-VPTYWWQVSA-N
CAS:这里用的两张来源表里没有。
IUPAC
[(3R,8R,9S,10R,13R,14R,16S,17S)-17-acetyl-3-[(2S,3S,4R,5R,6S)-5-[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)-3-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-2,3,4,7,