CHEBI:5728 - hirsutidin

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ChEBI Name hirsutidin
ChEBI ID CHEBI:5728
Definition An anthocyanidin cation consisting of benzopyrylium with hydroxy substituents at positions 3 and 5, a methoxy group at position 7 and a 4-hydroxy-3,5-dimethoxyphenyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H17O7
Net Charge +1
Average Mass 345.32280
Monoisotopic Mass 345.09688
InChI InChI=1S/C18H16O7/c1-22-10-6-12(19)11-8-13(20)18(25-14(11)7-10)9-4-15(23-2)17(21)16(5-9)24-3/h4-8H,1-3H3,(H2-,19,20,21)/p+1
InChIKey JGPCLGHKWGCWNO-UHFFFAOYSA-O
SMILES COc1cc(O)c2cc(O)c([o+]c2c1)-c1cc(OC)c(O)c(OC)c1
Metabolite of Species Details
Catharanthus roseus (NCBI:txid4058) See: PubMed
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.
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ChEBI Ontology
Outgoing hirsutidin (CHEBI:5728) has role plant metabolite (CHEBI:76924)
hirsutidin (CHEBI:5728) is a 5-hydroxyanthocyanidin (CHEBI:140277)
IUPAC Name
3,5-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-7-methoxy-1-benzopyran-1-ium
Manual Xrefs Databases
C00006619 KNApSAcK
C08643 KEGG COMPOUND
Hirsutidin Wikipedia
LMPK12010421 LIPID MAPS
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Registry Numbers Types Sources
4092-66-4 CAS Registry Number KEGG COMPOUND
6118726 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
12628396 PubMed citation Europe PMC
Last Modified
29 March 2018