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CHEBI:167487 - (+)-pisiferate

ChEBI IDCHEBI:167487
ChEBI Name(+)-pisiferate
Stars
DefinitionA monocarboxylic acid anion that is the conjugate base of (+)-pisiferic acid, arising from the deprotonation of the carboxy group. Major species at pH 7.3.
Last Modified16 February 2021
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H27O3
Net Charge-1
Average Mass315.433
Monoisotopic Mass315.19657
SMILES[H][C@@]12CCc3cc(C(C)C)c(O)cc3[C@@]1(C(=O)[O-])CCCC2(C)C
InChIInChI=1S/C20H28O3/c1-12(2)14-10-13-6-7-17-19(3,4)8-5-9-20(17,18(22)23)15(13)11-16(14)21/h10-12,17,21H,5-9H2,1-4H3,(H,22,23)/p-1/t17-,20-/m0/s1
InChIKeyATHWSPHADLLZSS-PXNSSMCTSA-M
ChEBI Ontology
Outgoing Relation(s)
(+)-pisiferate (CHEBI:167487) is a monocarboxylic acid anion (CHEBI:35757)
(+)-pisiferate (CHEBI:167487) is conjugate base of (+)-pisiferic acid (CHEBI:70576)
Incoming Relation(s)
(+)-pisiferic acid (CHEBI:70576) is conjugate acid of (+)-pisiferate (CHEBI:167487)
IUPAC Name 
12-hydroxyabieta-8,11,13-trien-20-oate
UniProt Name  Source
pisiferateUniProt
Citations