Chemical Compound

CHEMBL2029642

CHEMBL2029642 chemical structure
Primary Record

CHEMBL2029642

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
70687897
SMILES
C[C@@H]1CC[C@H]([C@@H](C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(=O)C4=CC=C(C=C4)Br)OC(=O)C5=CC=C(C=C5)Br)O)O)O)O)O)C(C)C
Canonical SMILES
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](COC(=O)c3ccc(Br)cc3)[C@@H](OC(=O)c3ccc(Br)cc3)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O

Names & Synonyms

  • CHEMBL2029642
  • J2.592.516E
  • [(2R,3S,4R,5R,6R)-3-(4-bromobenzoyloxy)-4,5-dihydroxy-6-{[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}oxan-2-yl]methoxy}oxan-2-yl]methyl 4-bromobenzoate
  • 1-O-[(1R,3R,4S)-p-Menthane-3-yl]-6-O-[4-O,6-O-bis(4-bromobenzoyl)-beta-D-glucopyranosyl]-beta-D-glucopyranose