Acetylaleuritolic acid

cas: 28937-85-1 — see every product listed under this CAS number, including other names

Acetylaleuritolic acid (CAS 28937-85-1) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-122997-Get quote
cas28937-85-1
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Structural formula: {0} (CAS {1})

Acetyl aleuritolic acid is a monocarboxylic acid, a pentacyclic triterpenoid and an acetate ester. It has a role as an antineoplastic agent and a plant metabolite. It is functionally related to a friedelin.

Source: ChEBI

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

Computed by PubChem (NCBI)

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