CHEBI:70221 - Dichotomide XIII, (rel)-

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ChEBI Name Dichotomide XIII, (rel)-
ChEBI ID CHEBI:70221
Definition A natural product found in Stellaria dichotoma var. lanceolata.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H25N3O6
Net Charge 0
Average Mass 439.46110
Monoisotopic Mass 439.17434
InChI InChI=1S/C23H25N3O6/c1-3-4-11-32-19(28)10-9-17(23(30)31)26-22(29)18-12-15-14-7-5-6-8-16(14)24-21(15)20(25-18)13(2)27/h5-8,12,17,24H,3-4,9-11H2,1-2H3,(H,26,29)(H,30,31)/t17-/m0/s1
InChIKey GKBSOIHLWSOULK-KRWDZBQOSA-N
SMILES CCCCOC(=O)CC[C@H](NC(=O)c1cc2c3ccccc3[nH]c2c(n1)C(C)=O)C(O)=O
Metabolite of Species Details
Stellaria dichotoma var. lanceolata (IPNI:50920984-1) Found in root (BTO:0001188). Methanolic extract of air-dried, powdered roots 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 Dichotomide XIII, (rel)- (CHEBI:70221) has role metabolite (CHEBI:25212)
Dichotomide XIII, (rel)- (CHEBI:70221) is a harmala alkaloid (CHEBI:61379)
Citation Waiting for Citations Type Source
21090796 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:beta-carbolines(CHEBI:60834); ISA:N-acyl-amino acid(CHEBI:51569); ISA:alpha-amino acid(CHEBI:33704); ISA:pyridinemonocarboxylic acid(CHEBI:26420); ISA:aromatic carboxylic acid(CHEBI:33859); ISA:indoles(CHEBI:24828); ISA:aromatic ketone(CHEBI:76224); ISA:aralkylamine(CHEBI:18000); ISA:fatty acid ester(CHEBI:35748); ISA:amino fatty acid(CHEBI:59650); ISA:dicarboxylic acid(CHEBI:35692); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:pyrroles(CHEBI:26455); ISA:enamine(CHEBI:47989); ISA:carboxylic ester(CHEBI:33308); ISA:carboxamide(CHEBI:37622); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698); ISA:carboxylic acid(CHEBI:33575);