CHEBI:70036 - Cajanin

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ChEBI Name Cajanin
ChEBI ID CHEBI:70036
Definition A natural product found in Crotalaria lachnophora.
Stars This entity has been manually annotated by a third party.
Secondary ChEBI IDs CHEBI:3297
Supplier Information
Download Molfile XML SDF
Formulae C16H12O6
C16H12O6
Net Charge 0
Average Mass 300.26290
Monoisotopic Mass 300.06339
InChI InChI=1S/C16H12O6/c1-21-9-5-13(19)15-14(6-9)22-7-11(16(15)20)10-3-2-8(17)4-12(10)18/h2-7,17-19H,1H3
InChIKey ALFNTRJPGFNJQV-UHFFFAOYSA-N
SMILES COc1cc(O)c2c(c1)occ(-c1ccc(O)cc1O)c2=O
Metabolite of Species Details
Crotalaria lachnophora (IPNI:488342-1) Found in whole plant (BTO:0001461). Chloroform soluble fraction of CH2Cl2/MeOH (1:1) crude extract of dried and powdered whole plant 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Cajanin (CHEBI:70036) has role metabolite (CHEBI:25212)
Cajanin (CHEBI:70036) is a 7-methoxyisoflavones (CHEBI:140356)
Synonyms Sources
3-(2,4-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one ChEBI
5,2',4'-Trihydroxy-7-methoxyisoflavone ChEBI
Cajanin KEGG COMPOUND
Manual Xrefs Databases
C00002512 KNApSAcK
C10203 KEGG COMPOUND
HMDB0032696 HMDB
View more database links
Registry Number Type Source
32884-36-9 CAS Registry Number KEGG COMPOUND
Citation Waiting for Citations Type Source
21265557 PubMed citation Europe PMC
Last Modified
02 April 2018
General Comment
2014-10-17 Suggested Classification: ISA:chromones(CHEBI:23238); ISA:phenols(CHEBI:33853); ISA:methoxybenzene(CHEBI:51683); ISA:resorcinols(CHEBI:33572); ISA:pyranone(CHEBI:37963); ISA:aromatic ether(CHEBI:35618); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enol(CHEBI:33823); ISA:polyol(CHEBI:26191); ISA:aromatic alcohol(CHEBI:33854);