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CHEBI:204311 - Penicitide B

ChEBI IDCHEBI:204311
ChEBI NamePenicitide B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H34O5
Net Charge0
Average Mass330.465
Monoisotopic Mass330.24062
SMILESCC(CCCC[C@H]1C[C@H](O)CC(=O)O1)CC(C)(O)CC[C@@H](C)O
InChIInChI=1S/C18H34O5/c1-13(12-18(3,22)9-8-14(2)19)6-4-5-7-16-10-15(20)11-17(21)23-16/h13-16,19-20,22H,4-12H2,1-3H3/t13?,14-,15+,16+,18?/m1/s1
InChIKeyVOOPCCURDRUEPN-PLQZLIEUSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (21339945)
ChEBI Ontology
Outgoing Relation(s)
Penicitide B (CHEBI:204311) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(4S,6S)-6-[(10R)-7,10-dihydroxy-5,7-dimethylundecyl]-4-hydroxyoxan-2-one
Manual XrefsDatabases
27025566ChemSpider