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CHEBI:212197 - Peniciginseng A

ChEBI IDCHEBI:212197
ChEBI NamePeniciginseng A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESCCCCC/C=C\C/C=C\[C@@H](O)CCCCCCC(=O)OO
InChIInChI=1S/C18H32O4/c1-2-3-4-5-6-7-8-11-14-17(19)15-12-9-10-13-16-18(20)22-21/h6-7,11,14,17,19,21H,2-5,8-10,12-13,15-16H2,1H3/b7-6-,14-11-/t17-/m1/s1
InChIKeyTZTWGGYPSZSNBQ-VEPOBDBYSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies YIM PH 30003 (ncbitaxon:1564175) - DOI (10.1016/j.phytol.2015.01.010)
ChEBI Ontology
Outgoing Relation(s)
Peniciginseng A (CHEBI:212197) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(8S,9Z,12Z)-8-hydroxyoctadeca-9,12-dieneperoxoic acid
Manual XrefsDatabases
78442040ChemSpider