Chemical Compound

3-O-cis-Coumaroyl alphitolic acid

3-O-cis-Coumaroyl alphitolic acid chemical structure
Primary Record

3-O-cis-Coumaroyl alphitolic acid

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
102014801
SMILES
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@H]4[C@]([C@@]3(CC2)C)(CC[C@@H]5[C@@]4(C[C@H]([C@@H](C5(C)C)OC(=O)/C=C\C6=CC=C(C=C6)O)O)C)C)C(=O)O
Canonical SMILES
C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](OC(=O)/C=C\c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12

Names & Synonyms

  • 3-O-cis-Coumaroyl alphitolic acid
  • 3-O-cis-p-coumaroylalphitolic acid
  • 3-O-(cis-p-coumaroyl)-alphitolic acid
  • J1.472.231I
  • 2alpha-Hydroxy-3beta-(4-hydroxy-cis-cinnamoyloxy)lupa-20(29)-ene-28-oic acid
  • 3beta-[(Z)-3-(4-Hydroxyphenyl)propenoyloxy]-2alpha-hydroxylupa-20(29)-ene-28-oic acid
  • (1R,3aS,5aR,5bR,7aR,9R,10R,11aR,11bR,13aR,13bR)-10-hydroxy-9-{[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid