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CHEBI:231746 - 17,18-epoxy-17-hydroxycur-19-ene(1+)

ChEBI IDCHEBI:231746
ChEBI Name17,18-epoxy-17-hydroxycur-19-ene(1+)
Stars
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC19H23N2O2
Net Charge+1
Average Mass311.405
Monoisotopic Mass311.17540
SMILES[H][C@@]12Nc3ccccc3[C@@]13CC[NH+]1CC4=CCOC(O)[C@]2([H])[C@@]4([H])C[C@]13[H]
InChIInChI=1S/C19H22N2O2/c22-18-16-12-9-15-19(6-7-21(15)10-11(12)5-8-23-18)13-3-1-2-4-14(13)20-17(16)19/h1-5,12,15-18,20,22H,6-10H2/p+1/t12-,15-,16+,17-,18?,19+/m0/s1
InChIKeyUFUDXCDPABDFHK-OZGWKUSCSA-O
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
17,18-epoxy-17-hydroxycur-19-ene(1+) (CHEBI:231746) is a monoterpenoid indole alkaloid (CHEBI:65323)
17,18-epoxy-17-hydroxycur-19-ene(1+) (CHEBI:231746) is a organic heterohexacyclic compound (CHEBI:51914)
17,18-epoxy-17-hydroxycur-19-ene(1+) (CHEBI:231746) is a primary alcohol (CHEBI:15734)
17,18-epoxy-17-hydroxycur-19-ene(1+) (CHEBI:231746) is conjugate acid of caracurine VII (CHEBI:141968)
Incoming Relation(s)
caracurine VII (CHEBI:141968) is conjugate base of 17,18-epoxy-17-hydroxycur-19-ene(1+) (CHEBI:231746)
Synonym  Source
Wieland-Gumlich aldehyde(1+)SUBMITTER
UniProt Name  Source
17,18-epoxy-17-hydroxycur-19-eneUniProt
Citations