3-O-Acetyloleanolic Acid

cas: 4339-72-4 — see every product listed under this CAS number, including other names

3-O-Acetyloleanolic Acid (CAS 4339-72-4) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULB227003
cas4339-72-4
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid (CAS 4339-72-4) is a chemical compound with the molecular formula C32H50O4 and a molecular weight of 498.7 g/mol. IUPAC name: (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid. InChIKey: RIXNFYQZWDGQAE-DFHVBEEKSA-N.

Identity
Molecular formulaC32H50O4
Molecular weight498.7 g/mol
IUPAC name(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChIKeyRIXNFYQZWDGQAE-DFHVBEEKSA-N
SMILESCC(=O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)C

Computed by PubChem (NCBI)

Synonyms: 3-O-Acetyloleanolic acid, Oleanolic acid 3-acetate, Acetyl oleanolic acid, Oleanolic acid acetate, 3-?O-?Acetyloleanolic acid, Acetyloleanolic acid, Olean-12-en-28-oic acid, 3-(acetyloxy)-, (3beta)-, acetyl oleanic acid, 3beta-acetoxyolean-12-en-28-oic acid, 3--cetyloleanolic acid
Isomers (same molecular formula)
(3R,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-3-acetyloxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picene-4-carboxylic acid C32H50O4
(3R,4R,4aR,6aR,6bS,8aR,12aR,14aR,14bR)-3-acetyloxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid C32H50O4
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-acetyloxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid C32H50O4

Also listed as

3-​O-​Acetyloleanolic acid/ 99.2% (existing batch purity) TargetMol CAS 4339-72-4
3-O-Acetyloleanolic acid 98% Ambeed CAS 4339-72-4
3-O-Acetyloleanolic acid, 98%, 98% Chemat CAS 4339-72-4
3-​O-​Acetyloleanolic acid, 99.84% MedChemExpress CAS 4339-72-4