CHEBI:200771 - Ascotrichic acid

ChEBI IDCHEBI:200771
ChEBI NameAscotrichic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O4
Net Charge0
Average Mass270.369
Monoisotopic Mass270.18311
SMILESCC(=CCCC(C)(O)[C@@H]1CC[C@@](C)(O)[C@H]1C)C(=O)O
InChIInChI=1S/C15H26O4/c1-10(13(16)17)6-5-8-15(4,19)12-7-9-14(3,18)11(12)2/h6,11-12,18-19H,5,7-9H2,1-4H3,(H,16,17)/t11-,12+,14+,15?/m0/s1
InChIKeyZPWDBKOJTSRRKI-KCGXDXBQSA-N
Species of MetaboliteComponentSourceComments
Ascotrichaspecies ZJ-M-5 (ncbitaxon:1217164) - PubMed (22840229)
ChEBI Ontology
Outgoing Relation(s)
Ascotrichic acid (CHEBI:200771) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
6-hydroxy-6-[(1R,2S,3R)-3-hydroxy-2,3-dimethylcyclopentyl]-2-methylhept-2-enoic acid
Manual XrefsDatabases
78436669ChemSpider