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CHEBI:208440 - Nocarditriene

ChEBI IDCHEBI:208440
ChEBI NameNocarditriene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27NO2
Net Charge0
Average Mass301.430
Monoisotopic Mass301.20418
SMILESCC/C=C/C=C(C)/C=C/C=C/CC(C)(O)C1=NCC[C@H]2O[C@@H]12
InChIInChI=1S/C19H27NO2/c1-4-5-7-10-15(2)11-8-6-9-13-19(3,21)18-17-16(22-17)12-14-20-18/h5-11,16-17,21H,4,12-14H2,1-3H3/b7-5+,9-6+,11-8+,15-10+/t16-,17-,19?/m1/s1
InChIKeyJTAXSEZBNKIDIJ-SXBFSDCCSA-N
Species of MetaboliteComponentSourceComments
Nocardiopsis (ncbitaxon:2013) - PubMed (30272441)
ChEBI Ontology
Outgoing Relation(s)
Nocarditriene (CHEBI:208440) is a gitoxigenin (CHEBI:38105)
Nocarditriene (CHEBI:208440) is a organonitrogen heterocyclic compound (CHEBI:38101)
IUPAC Name 
(4E,6E,8E,10E)-8-methyl-2-[(1S,6R)-7-oxa-3-azabicyclo[4.1.0]hept-2-en-2-yl]trideca-4,6,8,10-tetraen-2-ol
Manual XrefsDatabases
71048643ChemSpider