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> Main
CHEBI:75318 - petunidin
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ChEBI Name
petunidin
ChEBI ID
CHEBI:75318
Definition
An anthocyanidin cation that is flavylium bearing five hydroxy substituents at positions 3, 3', 4', 5 and 7 as well as a methoxy substituent at position 5'.
Stars
This entity has been manually annotated by the ChEBI Team.
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Read full article at Wikipedia
Formula
C16H13O7
Net Charge
+1
Average Mass
317.27020
Monoisotopic Mass
317.06558
InChI
InChI=1S/C16H12O7/c1-
22-
14-
3-
7(2-
11(19)
15(14)
21)
16-
12(20)
6-
9-
10(18)
4-
8(17)
5-
13(9)
23-
16/h2-
6H,1H3,(H4-
,17,18,19,20,21)
/p+1
InChIKey
AFOLOMGWVXKIQL-UHFFFAOYSA-O
SMILES
COc1cc(cc(O)c1O)-c1[o+]c2cc(O)cc(O)c2cc1O
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
petunidin (
CHEBI:75318
)
has role
plant metabolite (
CHEBI:76924
)
petunidin (
CHEBI:75318
)
is a
5-hydroxyanthocyanidin (
CHEBI:140277
)
petunidin (
CHEBI:75318
)
is conjugate acid of
petunidin(1−) (
CHEBI:193101
)
Incoming
petunidin 3-
O
-β-
D
-glucoside (
CHEBI:31985
)
has functional parent
petunidin (
CHEBI:75318
)
petunidin 3-
O
-(6-
O
-(
E
)-4-coumaroyl-β-
D
-glucoside) (
CHEBI:75709
)
has functional parent
petunidin (
CHEBI:75318
)
petunidin 3-
O
-(6-
O
-(
Z
)-4-coumaroyl-β-
D
-glucoside) (
CHEBI:75708
)
has functional parent
petunidin (
CHEBI:75318
)
petunidin(1−) (
CHEBI:193101
)
is conjugate base of
petunidin (
CHEBI:75318
)
IUPAC Name
2-(3,4-dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxychromenium
Synonyms
Sources
2-(3,4-dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxy-1-benzopyrylium
ChEBI
3,3',4',5,7-pentahydroxy-5'-methoxyflavylium
ChEBI
Petunidin chloride
KEGG COMPOUND
petunidol
ChEBI
Pt
ChEBI
Manual Xrefs
Databases
C08727
KEGG COMPOUND
CPD-15003
MetaCyc
LMPK12010005
LIPID MAPS
Petunidin
Wikipedia
View more database links
Registry Numbers
Types
Sources
1429-30-7
CAS Registry Number
KEGG COMPOUND
3914715
Reaxys Registry Number
Reaxys
Citations
Types
Sources
23993625
PubMed citation
Europe PMC
24363205
PubMed citation
Europe PMC
24483298
PubMed citation
Europe PMC
24506267
PubMed citation
Europe PMC
24689289
PubMed citation
Europe PMC
Last Modified
29 March 2018