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CHEBI:57808 - xanthommatin(1−)
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ChEBI Name
xanthommatin(1−)
ChEBI ID
CHEBI:57808
ChEBI ASCII Name
xanthommatin(1-)
Definition
Conjugate base of xanthommatin having both carboxy groups deprotonated and the amino group protonated; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C20H12N3O8
Net Charge
-1
Average Mass
422.32460
Monoisotopic Mass
422.06299
InChI
InChI=1S/C20H13N3O8/c21-
8(19(27)
28)
4-
10(24)
7-
2-
1-
3-
13-
16(7)
23-
18-
14(31-
13)
6-
12(26)
17-
15(18)
11(25)
5-
9(22-
17)
20(29)
30/h1-
3,5-
6,8H,4,21H2,(H,22,25)
(H,27,28)
(H,29,30)
/p-
1
InChIKey
QLAHWTNCEYYDRR-UHFFFAOYSA-M
SMILES
[NH3+]C(CC(=O)c1cccc2oc3cc(=O)c4nc(cc(O)c4c3nc12)C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing
xanthommatin(1−) (
CHEBI:57808
)
is a
amino-acid anion (
CHEBI:37022
)
xanthommatin(1−) (
CHEBI:57808
)
is conjugate base of
xanthommatin (
CHEBI:16550
)
Incoming
xanthommatin (
CHEBI:16550
)
is conjugate acid of
xanthommatin(1−) (
CHEBI:57808
)
IUPAC Name
11-
(3-
azaniumyl-
3-
carboxylatopropanoyl)-
1-
hydroxy-
5-
oxo-
5
H
-
pyrido[3,2-
a
]phenoxazine-
3-
carboxylate
Synonyms
Sources
xanthommatin
UniProt
xanthommatin anion
ChEBI
Last Modified
13 November 2017