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CHEBI:63659 - 9β-pimara-7,15-dien-19-oate

ChEBI IDCHEBI:63659
ChEBI Name9β-pimara-7,15-dien-19-oate
Stars
ASCII Name9beta-pimara-7,15-dien-19-oate
DefinitionA monocarboxylic acid anion resulting from the deprotonation of 9β-pimara-7,15-dien-19-oic acid; the major species at pH 7.3
Last Modified24 January 2012
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H29O2
Net Charge-1
Average Mass301.450
Monoisotopic Mass301.21730
SMILES[H][C@@]12CC=C3C[C@](C)(C=C)CC[C@@]3([H])[C@@]1(C)CCC[C@]2(C)C(=O)[O-]
InChIInChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/p-1/t15-,16-,18-,19-,20+/m1/s1
InChIKeyMXYATHGRPJZBNA-BDUQCRIQSA-M
ChEBI Ontology
Outgoing Relation(s)
9β-pimara-7,15-dien-19-oate (CHEBI:63659) is a monocarboxylic acid anion (CHEBI:35757)
9β-pimara-7,15-dien-19-oate (CHEBI:63659) is conjugate base of 9β-pimara-7,15-dien-19-oic acid (CHEBI:63731)
Incoming Relation(s)
9β-pimara-7,15-dien-19-oic acid (CHEBI:63731) is conjugate acid of 9β-pimara-7,15-dien-19-oate (CHEBI:63659)
IUPAC Name 
(9β)-pimara-7,15-dien-19-oate
Synonym  Source
(1S,4aR,4bR,7R,10aR)-7-ethenyl-1,4a,7-trimethyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydrophenanthrene-1-carboxylateIUPAC
UniProt Name  Source
9β-pimara-7,15-dien-19-oateUniProt
Citations