Chemical Compound

(1S,3S,4S,5R,6R,7R)-1-(4-acetoxy-5-methyl-6-phenyl-hexyl)-4,7-dihydroxy-6-[(E)-6-methyl-9-phenyl-non-4-enoyl]oxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylate

(1S,3S,4S,5R,6R,7R)-1-(4-acetoxy-5-methyl-6-phenyl-hexyl)-4,7-dihydroxy-6-[(E)-6-methyl-9-phenyl-non-4-enoyl]oxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylate 结构式
Primary record

(1S,3S,4S,5R,6R,7R)-1-(4-acetoxy-5-methyl-6-phenyl-hexyl)-4,7-dihydroxy-6-[(E)-6-methyl-9-phenyl-non-4-enoyl]oxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
25244795
SMILES
CC(CCCC1=CC=CC=C1)/C=C/CCC(=O)O[C@@H]2[C@H]([C@]3(O[C@@H]([C@]([C@@]2(O3)C(=O)[O-])(C(=O)[O-])O)C(=O)[O-])CCCC(C(C)CC4=CC=CC=C4)OC(=O)C)O
Canonical SMILES
CC(=O)OC(CCC[C@]12O[C@H](C(=O)[O-])[C@@](O)(C(=O)[O-])[C@](C(=O)[O-])(O1)[C@H](OC(=O)CC/C=C/C(C)CCCc1ccccc1)[C@H]2O)C(C)Cc1ccccc1

名称与同义词

  • zaragozic acid C
  • CPD-4585
  • (1S,3S,4S,5R,6R,7R)-1-(4-acetoxy-5-methyl-6-phenyl-hexyl)-4,7-dihydroxy-6-[(E)-6-methyl-9-phenyl-non-4-enoyl]oxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylate