CHEBI:18057 - vellosimine

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ChEBI Name vellosimine
ChEBI ID CHEBI:18057
Definition An indole alkaloid that is sarpagan in which the methyl group attached to position 16 has been oxidised to the corresponding aldehyde.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:9942, CHEBI:15305, CHEBI:58362, CHEBI:57765
Supplier Information
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Formulae C19H20N2O
C19H20N2O
Net Charge 0
Average Mass 292.37490
Monoisotopic Mass 292.15756
InChI InChI=1S/C19H20N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,10,13,15,17-18,20H,7-9H2,1H3/b11-2-/t13-,15+,17-,18-/m0/s1
InChIKey MHASSCPGKAMILD-VICVVEARSA-N
SMILES C\C=C1\CN2[C@H]3Cc4c([nH]c5ccccc45)[C@@H]2C[C@@H]1[C@H]3C=O
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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 vellosimine (CHEBI:18057) has parent hydride sarpagan (CHEBI:36312)
vellosimine (CHEBI:18057) has role plant metabolite (CHEBI:76924)
vellosimine (CHEBI:18057) is a aldehyde (CHEBI:17478)
vellosimine (CHEBI:18057) is a indole alkaloid (CHEBI:38958)
vellosimine (CHEBI:18057) is a organic heteropentacyclic compound (CHEBI:38164)
IUPAC Name
sarpagan-17-al
Synonyms Sources
(+)-vellosimine ChemIDplus
vellosimine UniProt
Vellosimine KEGG COMPOUND
Manual Xrefs Databases
C11634 KEGG COMPOUND
EVS PDBeChem
VELLOSIMINE MetaCyc
View more database links
Registry Numbers Types Sources
6874-98-2 CAS Registry Number KEGG COMPOUND
6874-98-2 CAS Registry Number ChemIDplus
6894764 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10891229 PubMed citation Europe PMC
14510528 PubMed citation Europe PMC
20392128 PubMed citation Europe PMC
Last Modified
04 August 2014