Chemical Compound

DTXSID601112418

CAS Registry Number 97892-86-9
DTXSID601112418 chemical structure
Primary Record

DTXSID601112418

In stock
5,824 g
Purity
99.0 %
CAS
97892-86-9

Compound Identifiers & Properties

CAS
97892-86-9
PubChem CID
165340230
SMILES
C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)O[C@H]8C(C([C@@H]([C@H](O8)CO)O)O)O
Canonical SMILES
CC1(C)CC[C@]2(C(=O)O)[C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)C(O)C6O)[C@@](C)(C=O)[C@@H]5CC[C@]43C)[C@@H]2C1

Names & Synonyms

  • DTXSID601112418
  • 16alpha,28-Dihydroxy-23,28-dioxoolean-12-en-3beta-yl L-threo-hexopyranosyl-(1->2)-[beta-D-xylopyranosyl-(1->3)]-beta-D-glucopyranosiduronic acid
  • 97892-86-9
  • Quillaic acid 3-O-{I(2)-D-xylopyranosyl-(1a3)-[I(2)-D-galactopyranosyl-(1a2)]-I(2)-D-glucopyranosiduronic acid}