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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:5832 - hypaphorine
Main
ChEBI Ontology
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ChEBI Name
hypaphorine
ChEBI ID
CHEBI:5832
Definition
An amino acid betaine obtaine by exhaustive methylation of the α-amino group of
L
-tryptophan with concomitant deprotonation of the carboxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C14H18N2O2
Net Charge
0
Average Mass
246.305
Monoisotopic Mass
246.13683
InChI
InChI=1S/C14H18N2O2/c1-
16(2,3)
13(14(17)
18)
8-
10-
9-
15-
12-
7-
5-
4-
6-
11(10)
12/h4-
7,9,13,15H,8H2,1-
3H3/t13-
/m0/s1
InChIKey
AOHCBEAZXHZMOR-ZDUSSCGKSA-N
SMILES
C1(=CNC2=C1C=CC=C2)C[C@@H](C(=O)[O-])[N+](C)(C)C
Metabolite of Species
Details
Erythrina suberosa
(NCBI:txid1288013)
Found in seed
(BTO:0001226)
. See:
PubMed
Pisolithus microcarpus
(NCBI:txid178872)
See:
PubMed
Pisolithus tinctorius
(NCBI:txid37468)
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.
xenobiotic
A xenobiotic (Greek,
xenos
"foreign";
bios
"life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
alkaloid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
hypaphorine (
CHEBI:5832
)
has role
fungal metabolite (
CHEBI:76946
)
hypaphorine (
CHEBI:5832
)
has role
plant metabolite (
CHEBI:76924
)
hypaphorine (
CHEBI:5832
)
has role
xenobiotic (
CHEBI:35703
)
hypaphorine (
CHEBI:5832
)
is a
L
-tryptophan derivative (
CHEBI:47994
)
hypaphorine (
CHEBI:5832
)
is a
amino-acid betaine (
CHEBI:22860
)
hypaphorine (
CHEBI:5832
)
is a
indole alkaloid (
CHEBI:38958
)
IUPAC Name
(2
S
)-3-(1
H
-indol-3-yl)-2-(trimethylazaniumyl)propanoate
Synonyms
Sources
(+)-Hypaphorine
ChemIDplus
Glyyunnanenine
ChemIDplus
Hypaphorine
KEGG COMPOUND
L-Hypaphorine
ChemIDplus
L
-tryptophan betaine
ChEBI
Lenticin
KEGG COMPOUND
N
,
N
,
N
-trimethyltryptophan betaine
ChEBI
N
α
,
N
α
,
N
α
-
trimethyl-
L
-
tryptophan
UniProt
Tryptophan betaine
ChemIDplus
Manual Xrefs
Databases
C00001740
KNApSAcK
C09213
KEGG COMPOUND
HMDB0061115
HMDB
View more database links
Registry Numbers
Types
Sources
3558356
Reaxys Registry Number
Reaxys
487-58-1
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10659705
PubMed citation
Europe PMC
11089686
PubMed citation
Europe PMC
11676477
PubMed citation
Europe PMC
12056802
PubMed citation
Europe PMC
12236599
PubMed citation
Europe PMC
12710900
PubMed citation
Europe PMC
14504925
PubMed citation
Europe PMC
15032848
PubMed citation
Europe PMC
16547865
PubMed citation
Europe PMC
17370110
PubMed citation
Europe PMC
18404567
PubMed citation
Europe PMC
18571406
PubMed citation
Europe PMC
18968328
PubMed citation
Europe PMC
23855762
PubMed citation
Europe PMC
5348524
PubMed citation
Europe PMC
9951730
PubMed citation
Europe PMC
IND20800355
Agricola citation
Europe PMC
Last Modified
09 July 2024