CHEBI:67516 - 19(E)-18-demethoxygardfloramine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 19(E)-18-demethoxygardfloramine
ChEBI ID CHEBI:67516
Definition A natural product found in Gardneria ovata.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H22N2O4
Net Charge 0
Average Mass 366.41040
Monoisotopic Mass 366.15796
InChI InChI=1S/C21H22N2O4/c1-3-10-7-23-14-6-21-16(23)4-11(10)12(14)8-25-20(21)22-13-5-15-18(27-9-26-15)19(24-2)17(13)21/h3,5,11-12,14,16H,4,6-9H2,1-2H3/b10-3-/t11-,12-,14-,16-,21-/m0/s1
InChIKey UWJUSKOAJYNKFW-PAZSNEKJSA-N
SMILES [H][C@]12C[C@]34C(OC[C@@]1([H])[C@]1([H])C[C@]3([H])N2C\C1=C\C)=Nc1cc2OCOc2c(OC)c41
Metabolite of Species Details
Gardneria ovata (NCBI:txid84944) Found in aerial part (BTO:0001658). 90% methanolic extract of air-dried and powdered aerial parts See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 19(E)-18-demethoxygardfloramine (CHEBI:67516) has role metabolite (CHEBI:25212)
19(E)-18-demethoxygardfloramine (CHEBI:67516) is a tropane alkaloid (CHEBI:37332)
Citation Waiting for Citations Type Source
21425787 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:indolizines(CHEBI:38485); ISA:indoles(CHEBI:24828); ISA:benzodioxoles(CHEBI:38298); ISA:methoxybenzene(CHEBI:51683); ISA:quinuclidines(CHEBI:26518); ISA:oxacycle(CHEBI:38104); ISA:aromatic ether(CHEBI:35618); ISA:aralkylamine(CHEBI:18000); ISA:imidate(CHEBI:52479); ISA:piperidines(CHEBI:26151); ISA:N-alkylpyrrolidine(CHEBI:46775); ISA:tertiary amine(CHEBI:32876); ISA:dipolar compound(CHEBI:51151); ISA:acetal(CHEBI:59769);