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ChEBI
> Main
CHEBI:89510 - Deoxypyridinoline
Main
ChEBI Ontology
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ChEBI Name
Deoxypyridinoline
ChEBI ID
CHEBI:89510
Stars
This entity has been manually annotated by a third party.
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Formula
C18H28N4O7
Net Charge
0
Average Mass
412.438
Monoisotopic Mass
412.19580
InChI
InChI=1S/C18H28N4O7/c19-
12(16(24)
25)
3-
1-
2-
6-
22-
8-
10(4-
5-
13(20)
17(26)
27)
11(15(23)
9-
22)
7-
14(21)
18(28)
29/h8-
9,12-
14H,1-
7,19-
21H2,(H3-
,23,24,25,26,27,28,29)
/t12-
,13-
,14-
/m0/s1
InChIKey
ZAHDXEIQWWLQQL-IHRRRGAJSA-N
SMILES
C=1C(=C(C(=C[N+]1CCCC[C@@H](C(=O)O)N)O)C[C@@H](C(=O)O)N)CC[C@@H](C(=O)[O-])N
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in blood
(UBERON:0000178)
. See:
PubMed
ChEBI Ontology
Outgoing
Deoxypyridinoline (
CHEBI:89510
)
has functional parent
α-amino acid (
CHEBI:33704
)
Deoxypyridinoline (
CHEBI:89510
)
is a
organonitrogen compound (
CHEBI:35352
)
Deoxypyridinoline (
CHEBI:89510
)
is a
organooxygen compound (
CHEBI:36963
)
Synonyms
Sources
4-
(2-
Amino-
2-
carboxyethyl)-
1-
(5-
amino-
5-
carboxypentyl)-
3-
(3-
amino-
3-
carboxypropyl)-
5-
hydroxy-
Pyridinium inner salt stereoisomer
HMDB
4-
[(2S)-
2-
amino-
2-
carboxyethyl]-
3-
[(3S)-
3-
amino-
3-
carboxylatopropyl]-
1-
[(5S)-
5-
amino-
5-
carboxypentyl]-
5-
hydroxypyridin-
1-
ium
HMDB
Deoxipyridinoline
HMDB
Deoxy-pyridinoline
HMDB
Deoxypiridinoline
HMDB
Deoxypirydynoline
HMDB
Deoxypyridinolone
HMDB
Deoxypyridoline
HMDB
Desoxypyridinoline
HMDB
Lysylpyridinoline
HMDB
N-(5-Amino-5-carboxypentyl)-3-hydroxy-4-(2-amino-2-carboxyethyl)-5-(3-amino-3-carboxypropyl)pyridine
HMDB
Manual Xref
Database
HMDB0000569
HMDB
View more database links
Registry Number
Type
Source
83462-55-9
CAS Registry Number
KEGG COMPOUND
Citations
Types
Sources
10982756
PubMed citation
Europe PMC
11805003
PubMed citation
Europe PMC
12488435
PubMed citation
Europe PMC
12595629
PubMed citation
Europe PMC
15225370
PubMed citation
Europe PMC
15968302
PubMed citation
Europe PMC
16404967
PubMed citation
Europe PMC
16583470
PubMed citation
Europe PMC
16751696
PubMed citation
Europe PMC
17022050
PubMed citation
Europe PMC
17229003
PubMed citation
Europe PMC
7987481
PubMed citation
Europe PMC
8450043
PubMed citation
Europe PMC
8581871
PubMed citation
Europe PMC