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(Q106345625)
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English
L-mimosine zwitterion
chemical compound
(2S)-2-azaniumyl-3-(3-hydroxy-4-oxopyridin-1(4H)-yl)propanoate
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
part of
mimosinase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
198.0640568
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
mimosine
1 reference
based on heuristic
inferred from InChI
tautomer of
mimosine
1 reference
stated in
ChEBI release 2021-03-01
chemical formula
C₈H₁₀N₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(Cn1ccc(=O)c(O)c1)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N[C@@H](Cn1ccc(=O)c(O)c1)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C8H10N2O4/c9-5(8(13)14)3-10-2-1-6(11)7(12)4-10/h1-2,4-5,12H,3,9H2,(H,13,14)/t5-/m0/s1
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
1 reference
stated in
ChEBI release 2021-03-01
CAS Registry Number
500-44-7
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
440473
1 reference
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
6971294
1 reference
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
ChEBI ID
77689
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C8H10N2O4/c9-5(8(13)14)3-10-2-1-6(11)7(12)4-10/h1-2,4-5,12H,3,9H2,(H,13,14)/t5-/m0/s1
29063
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C8H10N2O4/c9-5(8(13)14)3-10-2-1-6(11)7(12)4-10/h1-2,4-5,12H,3,9H2,(H,13,14)/t5-/m0/s1
SureChEMBL ID
SCHEMBL41925
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
DSSTox substance ID
DTXSID401017244
1 reference
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
DrugBank ID
01055
1 reference
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
Human Metabolome Database ID
HMDB0015188
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
UNII
Z46B1LUI5N
1 reference
matched by identifier from
InChIKey
InChIKey
WZNJWVWKTVETCG-YFKPBYRVSA-N
Probes And Drugs ID
PD009575
0 references
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