Products 1649436-95-2

CAS 1649436-95-2 appears in our catalog under these names: 3α–Acetoxyurs–5:12–dien–24–oic acid, 3α-Acetoxyurs-5:12-dien-24-oic acid, (3α,4β)-3-(Acetyloxy)ursa-5,12-dien-23-oic acid, ≥98%. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 5mg, 1 mg, 5 mg.

Structural formula: {0} (CAS {1})

(3R,4R,6aR,6bS,8aR,11R,12S,12aR,14aS,14bR)-3-acetyloxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,6,7,8,9,10,11,12,12a,14,14a-dodecahydro-1H-picene-4-carboxylic acid (CAS 1649436-95-2) is a chemical compound with the molecular formula C32H48O4 and a molecular weight of 496.7 g/mol. IUPAC name: (3R,4R,6aR,6bS,8aR,11R,12S,12aR,14aS,14bR)-3-acetyloxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,6,7,8,9,10,11,12,12a,14,14a-dodecahydro-1H-picene-4-carboxylic acid. InChIKey: KFADRGGKRWPNDE-KMMZLYOWSA-N.

Identity
Molecular formulaC32H48O4
Molecular weight496.7 g/mol
IUPAC name(3R,4R,6aR,6bS,8aR,11R,12S,12aR,14aS,14bR)-3-acetyloxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,6,7,8,9,10,11,12,12a,14,14a-dodecahydro-1H-picene-4-carboxylic acid
InChIKeyKFADRGGKRWPNDE-KMMZLYOWSA-N
SMILESC[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC=C5[C@@]4(CC[C@H]([C@]5(C)C(=O)O)OC(=O)C)C)C)[C@@H]2[C@H]1C)C)C

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