Chemical Compound

J2.398.957C

J2.398.957C chemical structure
Primary Record

J2.398.957C

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101428282
SMILES
CC(=O)S[C@H]1[C@@H]2[C@@H](COC(O2)C3=CC=CC=C3)O[C@H]([C@@H]1OC(=O)C4=CC=CC=C4)O[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OCC=C)COC(=O)C8=CC=CC=C8
Canonical SMILES
C=CCO[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O[C@@H]2O[C@@H]3COC(c4ccccc4)O[C@@H]3[C@H](SC(C)=O)[C@H]2OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1

Names & Synonyms

  • J2.398.957C
  • (4aR,6S,7S,8S,8aS)-8-(acetylsulfanyl)-6-{[(2R,3R,4S,5R,6R)-4,5-bis(benzoyloxy)-2-[(benzoyloxy)methyl]-6-(prop-2-en-1-yloxy)oxan-3-yl]oxy}-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl benzoate
  • 1-O-Allyl-2-O,3-O,6-O-tribenzoyl-4-O-[2-O-benzoyl-3-deoxy-3-(acetylthio)-4-O,6-O-benzylidene-beta-D-galactopyranosyl]-beta-D-glucopyranose