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CHEBI:175482 - (ent-6alpha,7alpha,12alpha)-6,7,12-Trihydroxy-16-kauren-19-oic acid

ChEBI IDCHEBI:175482
ChEBI Name(ent-6alpha,7alpha,12alpha)-6,7,12-Trihydroxy-16-kauren-19-oic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O5
Net Charge0
Average Mass350.455
Monoisotopic Mass350.20932
SMILESC=C1CC23CC1C(O)CC2C1(C)CCCC(C)(C(=O)O)C1C(O)C3O
InChIInChI=1S/C20H30O5/c1-10-8-20-9-11(10)12(21)7-13(20)18(2)5-4-6-19(3,17(24)25)15(18)14(22)16(20)23/h11-16,21-23H,1,4-9H2,2-3H3,(H,24,25)
InChIKeyGDUDOACZUAVXMK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(ent-6alpha,7alpha,12alpha)-6,7,12-Trihydroxy-16-kauren-19-oic acid (CHEBI:175482) is a kaurane diterpenoid (CHEBI:53666)
IUPAC Name 
2,3,12-trihydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Manual XrefsDatabases
35014210ChemSpider
HMDB0036701HMDB