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CHEBI:211758 - 2-(6,7-Epoxy-12-hydroxy-1-oxo-2,4,10-farnesatrien-1-yl)pyrrole; (2Z,4E,6xi,7xi,10E)-form, 12-Aldehyde

ChEBI IDCHEBI:211758
ChEBI Name2-(6,7-Epoxy-12-hydroxy-1-oxo-2,4,10-farnesatrien-1-yl)pyrrole; (2Z,4E,6xi,7xi,10E)-form, 12-Aldehyde
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H23NO3
Net Charge0
Average Mass313.397
Monoisotopic Mass313.16779
SMILESCC(=C/C(=O)c1cccn1)/C=C/C1OC1(C)CC/C=C(\C)C=O
InChIInChI=1S/C19H23NO3/c1-14(12-17(22)16-7-5-11-20-16)8-9-18-19(3,23-18)10-4-6-15(2)13-21/h5-9,11-13,18,20H,4,10H2,1-3H3/b9-8+,14-12-,15-6+
InChIKeyDOHWELXZYDNVSW-SWFQEARZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (24272978)
ChEBI Ontology
Outgoing Relation(s)
2-(6,7-Epoxy-12-hydroxy-1-oxo-2,4,10-farnesatrien-1-yl)pyrrole; (2Z,4E,6xi,7xi,10E)-form, 12-Aldehyde (CHEBI:211758) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(E)-2-methyl-5-[2-methyl-3-[(1E,3Z)-3-methyl-5-oxo-5-(1H-pyrrol-2-yl)penta-1,3-dienyl]oxiran-2-yl]pent-2-enal