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

HCID 289984

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Basic information

CAS: 10376-50-8
Standard SMILES: C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(OC(C)=O)C(C)(C)C5CCC43C)C12
InChIKey: ACWNTJJUZAIOLW-UHFFFAOYSA-N
Molecular formula: C32H50O4
Average molar mass: 498.7 g/mol
Monoisotopic mass: 498.37091008

Overview

3-(acetyloxy)lup-20(29)-en-28-oic acid has been reported in Monascus purpureus, Eucalyptus globulus, and other organisms with data available.

Names & identifiers

Preferred name: 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
IUPAC: 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
English name: 3beta-Acetoxybetulinic acid
Molecular formula: C32H50O4
Molecular weight: 498.74

Names & synonyms

Betulinic acid acetate3Beta-acetoxybetulinic acidAcetylbetulinic acid9-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 acid3-(acetyloxy)lup-20(29)-en-28-oic acidBetulic acid acetateacetyl betulinic acidDTXSID90302661ACWNTJJUZAIOLW-UHFFFAOYSA-NNSC152533NSC-152533Lup-20(29)-en-28-oic acid, acetate

Show more names

3-O-Acetyl-betulinic acidAcetobetulinic acidAcetylbetulinicacid3-Acetoxybetulinic acid3β-Acetyloxylup-20(29)-en-28-oic acidLup-20(29)-en-28-oic acid, 3-(acetyloxy)-, (3β)-(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-acetoxy-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-acetoxy-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-3aH-cyclopenta[a]chrysene-3a-carboxylic acid