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> Main
CHEBI:144777 - pelargonidin(1−)
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ChEBI Name
pelargonidin(1−)
ChEBI ID
CHEBI:144777
ChEBI ASCII Name
pelargonidin(1-)
Definition
An organic anion obtained by selective deprotonation of the 3- and 5-hydroxy groups of pelargonidin; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Formula
C15H9O5
Net Charge
-1
Average Mass
269.233
Monoisotopic Mass
269.04555
InChI
InChI=1S/C15H10O5/c16-
9-
3-
1-
8(2-
4-
9)
15-
13(19)
7-
11-
12(18)
5-
10(17)
6-
14(11)
20-
15/h1-
7H,(H3-
,16,17,18,19)
/p-
1
InChIKey
XVFMGWDSJLBXDZ-UHFFFAOYSA-M
SMILES
C1=C(C=C2[O+]=C(C(=CC2=C1[O-])[O-])C=3C=CC(O)=CC3)O
ChEBI Ontology
Outgoing
pelargonidin(1−) (
CHEBI:144777
)
is a
anthocyanidin betaine (
CHEBI:143576
)
pelargonidin(1−) (
CHEBI:144777
)
is a
organic anion (
CHEBI:25696
)
pelargonidin(1−) (
CHEBI:144777
)
is conjugate base of
pelargonidin (
CHEBI:25863
)
Incoming
pelargonidin 3-
O
-β-
D
-galactoside betaine (
CHEBI:193099
)
has functional parent
pelargonidin(1−) (
CHEBI:144777
)
pelargonidin (
CHEBI:25863
)
is conjugate acid of
pelargonidin(1−) (
CHEBI:144777
)
IUPAC Name
7-hydroxy-2-(4-hydroxyphenyl)chromenium-3,5-bis(olate)
Synonyms
Sources
7-hydroxy-2-(4-hydroxyphenyl)-1-benzopyran-1-ium-3,5-bis(olate)
IUPAC
pelargonidin
UniProt
Manual Xref
Database
PELARGONIDIN-CMPD
MetaCyc
View more database links
Last Modified
07 September 2022