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CHEBI:209193 - Curindolizine

ChEBI IDCHEBI:209193
ChEBI NameCurindolizine
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H35N3O2
Net Charge0
Average Mass469.629
Monoisotopic Mass469.27293
SMILESCc1ccc2n1[C@@H]1[C@@H]3O[C@]([C@H](C)O)(C=C2)[C@H]1c1cc([C@H]2C=Cc4ccc(C)n4[C@@H]2C)c(C)n1[C@@H]3C
InChIInChI=1S/C30H35N3O2/c1-16-7-9-22-11-12-24(18(3)31(16)22)25-15-26-27-28-29(20(5)33(26)19(25)4)35-30(27,21(6)34)14-13-23-10-8-17(2)32(23)28/h7-15,18,20-21,24,27-29,34H,1-6H3/t18-,20-,21+,24+,27+,28+,29-,30+/m1/s1
InChIKeyHZWGVFQTKPIVCQ-WKGBWSPFSA-N
Species of MetaboliteComponentSourceComments
Curvulariaspecies IFB-Z10 (ncbitaxon:1526222) - PubMed (27046459)
ChEBI Ontology
Outgoing Relation(s)
Curindolizine (CHEBI:209193) is a organic heterobicyclic compound (CHEBI:27171)
Curindolizine (CHEBI:209193) is a organonitrogen heterocyclic compound (CHEBI:38101)
IUPAC Name 
(1S)-1-[(1R,2S,10R,12R,13R)-16-[(5R,6R)-3,5-dimethyl-5,6-dihydroindolizin-6-yl]-4,13,15-trimethyl-11-oxa-3,14-diazapentacyclo[8.8.0.02,12.03,7.014,18]octadeca-4,6,8,15,17-pentaen-10-yl]ethanol
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78439837ChemSpider