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CHEBI:205758 - Penicilloitin B

ChEBI IDCHEBI:205758
ChEBI NamePenicilloitin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H38O5
Net Charge0
Average Mass358.519
Monoisotopic Mass358.27192
SMILESCCCCC(O)C/C=C/CCCCCCCCC(=O)OCC(O)CO
InChIInChI=1S/C20H38O5/c1-2-3-13-18(22)14-11-9-7-5-4-6-8-10-12-15-20(24)25-17-19(23)16-21/h9,11,18-19,21-23H,2-8,10,12-17H2,1H3/b11-9+
InChIKeyZGDOOBRKAZVQOQ-PKNBQFBNSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies (ncbitaxon:5081) - PubMed (27522096)
ChEBI Ontology
Outgoing Relation(s)
Penicilloitin B (CHEBI:205758) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name 
2,3-dihydroxypropyl (E)-13-hydroxyheptadec-10-enoate
Manual XrefsDatabases
60596941ChemSpider