Chemical Compound

(1S,3R,7R,8S,9S,10R,12R,13R,14E,16S)-9-{[(2S,3R,4R,5S,6R)-5-{[(2S,4R,5S,6S)-5-(acetyloxy)-4-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-13-hydroxy-8-methoxy-3,12-dimethyl-5-oxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-7-yl acetate

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(1S,3R,7R,8S,9S,10R,12R,13R,14E,16S)-9-{[(2S,3R,4R,5S,6R)-5-{[(2S,4R,5S,6S)-5-(acetyloxy)-4-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-13-hydroxy-8-methoxy-3,12-dimethyl-5-oxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-7-yl acetate 结构式
Primary record

(1S,3R,7R,8S,9S,10R,12R,13R,14E,16S)-9-{[(2S,3R,4R,5S,6R)-5-{[(2S,4R,5S,6S)-5-(acetyloxy)-4-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-13-hydroxy-8-methoxy-3,12-dimethyl-5-oxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-7-yl acetate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177581337
SMILES
C[C@@H]1C[C@@H]([C@@H](C([C@@H](CC(=O)O[C@@H](C[C@H]2[C@@H](O2)/C=C/[C@@H]1O)C)OC(=O)C)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C)O[C@H]4C[C@@]([C@H]([C@@H](O4)C)OC(=O)C)(C)O)N(C)C)O)CC=O
Canonical SMILES
COC1[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(C)=O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)[C@@H](O)/C=C/[C@@H]2O[C@H]2C[C@@H](C)OC(=O)C[C@H]1OC(C)=O

名称与同义词

  • Maridomycin VI
  • J697.958K
  • (12S,13S)-12,13-Epoxy-12,13-dihydroleucomycin V 3,4 -diacetate
  • (1S,3R,7R,8S,9S,10R,12R,13R,14E,16S)-9-{[(2S,3R,4R,5S,6R)-5-{[(2S,4R,5S,6S)-5-(acetyloxy)-4-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-13-hydroxy-8-methoxy-3,12-dimethyl-5-oxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-7-yl acetate