Chemical Compound

AC1LA2Q5

AC1LA2Q5 chemical structure
Primary Record

AC1LA2Q5

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
460635
SMILES
CCCCOC(=O)O[C@@H]1[C@H]([C@]2(O[C@@H]([C@]([C@@]1(O2)C(=O)O)(C(=O)O)O)C(=O)O)CCC(=C)[C@H]([C@H](C)CC3=CC=CC=C3)OC(=O)C)O
Canonical SMILES
C=C(CC[C@]12O[C@H](C(=O)O)[C@@](O)(C(=O)O)[C@](C(=O)O)(O1)[C@H](OC(=O)OCCCC)[C@H]2O)[C@@H](OC(C)=O)[C@H](C)Cc1ccccc1

Names & Synonyms

  • AC1LA2Q5
  • CHEMBL315705
  • SQUELASTATIN ANALOG 33
  • AIDS027730
  • BDBM50281102
  • CID460635
  • (1S,3S,4S,5R,6R,7R)-1-((4S,5R)-4-Acetoxy-5-methyl-3-methylene-6-phenyl-hexyl)-6-butoxycarbonyloxy-4,7-dihydroxy-2,8-dioxa-bicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
  • (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetoxy-5-methyl-3-methylene-6-phenyl-hexyl]-6-butoxycarbonyloxy-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
  • (1S,3S,4S,5R,6R,7R)-1-[(4S,5R)-4-acetyloxy-5-methyl-3-methylidene-6-phenylhexyl]-6-butoxycarbonyloxy-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid