Chemical Compound

AC1NS3IB

AC1NS3IB chemical structure
Primary Record

AC1NS3IB

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
5327984
SMILES
C1C[C@H]([C@@H](CNC1)NC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC(=C(C(=C3)O)CC4=C(C=CC=C4O)C(=O)O)O
Canonical SMILES
O=C(N[C@@H]1CNCCC[C@H]1OC(=O)c1cc(O)c(Cc2c(O)cccc2C(=O)O)c(O)c1)c1ccc(O)cc1

Names & Synonyms

  • AC1NS3IB
  • BDBM3225
  • CID5327984
  • Modified Benzophenone Carbonyl, Balanol Analog 25
  • 2-[[2,6-dihydroxy-4-[(3R,4R)-3-[(4-hydroxybenzoyl)amino]azepan-4-yl]oxycarbonylphenyl]methyl]-3-hydroxybenzoic acid
  • 2-{[2,6-dihydroxy-4-({[(3R,4R)-3-[(4-hydroxybenzene)amido]azepan-4-yl]oxy}carbonyl)phenyl]methyl}-3-hydroxybenzoic acid
  • trans-4-[4-(2-Carboxy-6-hydroxybenzyl)-3,5-dihydroxybenzoyloxy]-3-(4-hydroxybenzamido)azepine