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CHEBI:175734 - 3alpha-Corosolic acid

Default Structure
ChEBI IDCHEBI:175734
ChEBI Name3alpha-Corosolic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O4
Net Charge0
Average Mass472.710
Monoisotopic Mass472.35526
SMILESCC1CCC2(C)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C(=O)O)C5CCC43C)C2C1C
InChIInChI=1S/C30H48O4/c1-17-10-12-26(3)14-15-28(5)19(23(26)18(17)2)8-9-21-27(4)16-20(31)24(32)30(7,25(33)34)22(27)11-13-29(21,28)6/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)
InChIKeyCAQINDLNYJDVHH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3alpha-Corosolic acid (CHEBI:175734) is a triterpenoid (CHEBI:36615)
IUPAC Name 
2,3-dihydroxy-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
Manual XrefsDatabases
16161158ChemSpider
HMDB0041043HMDB