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CHEBI:219271 - 12-hydroxysilphinene-15-oic acid

ChEBI IDCHEBI:219271
ChEBI Name12-hydroxysilphinene-15-oic acid
Stars
Last Modified31 January 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESC[C@@]1(CO)C[C@]2(C)CC=C[C@]23[C@H](C(=O)O)CC[C@@H]13
InChIInChI=1S/C15H22O3/c1-13(9-16)8-14(2)6-3-7-15(14)10(12(17)18)4-5-11(13)15/h3,7,10-11,16H,4-6,8-9H2,1-2H3,(H,17,18)/t10-,11-,13-,14-,15+/m0/s1
InChIKeyIMZVTBUONKOJNP-IXDBCEGASA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (17125229)
ChEBI Ontology
Outgoing Relation(s)
12-hydroxysilphinene-15-oic acid (CHEBI:219271) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,2R,5R,6R,8S)-6-(hydroxymethyl)-6,8-dimethyltricyclo[6.3.0.01,5]undec-10-ene-2-carboxylic acid
Manual XrefsDatabases
23326665ChemSpider