CHEBI:175527 - (ent-6alpha,7alpha,16alphaH)-6,7,17-Trihydroxy-19-kauranoic acid

ChEBI IDCHEBI:175527
ChEBI Name(ent-6alpha,7alpha,16alphaH)-6,7,17-Trihydroxy-19-kauranoic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O5
Net Charge0
Average Mass352.471
Monoisotopic Mass352.22497
SMILESCC1(C(=O)O)CCCC2(C)C1C(O)C(O)C13CC(CO)C(CCC21)C3
InChIInChI=1S/C20H32O5/c1-18-6-3-7-19(2,17(24)25)15(18)14(22)16(23)20-8-11(4-5-13(18)20)12(9-20)10-21/h11-16,21-23H,3-10H2,1-2H3,(H,24,25)
InChIKeyFQXFNQBHZJYODR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(ent-6alpha,7alpha,16alphaH)-6,7,17-Trihydroxy-19-kauranoic acid (CHEBI:175527) is a kaurane diterpenoid (CHEBI:53666)
IUPAC Name 
2,3-dihydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Manual XrefsDatabases
HMDB0036756HMDB
35014236ChemSpider