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English
L-selenocystathionine zwitterion
chemical compound
(2S)-2-azaniumyl-4-{[(2R)-2-azaniumyl-2-carboxylatoethyl]selanyl}butanoate
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
part of
selenocystathionine gamma-lyase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
270.011878228
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
L-selenocystathionine
1 reference
based on heuristic
inferred from InChI
tautomer of
L-selenocystathionine
1 reference
stated in
ChEBI release 2021-03-01
chemical formula
C₇H₁₄N₂O₄Se
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(CC[Se]CC(N)C(=O)O)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N[C@@H](CC[Se]C[C@H](N)C(=O)O)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C7H14N2O4Se/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
ZNWYDQPOUQRDLY-WHFBIAKZSA-N
1 reference
stated in
ChEBI release 2021-03-01
CAS Registry Number
23809-95-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
441455
1 reference
matched by identifier from
InChIKey
InChIKey
ZNWYDQPOUQRDLY-WHFBIAKZSA-N
52921580
1 reference
matched by identifier from
InChIKey
InChIKey
ZNWYDQPOUQRDLY-WHFBIAKZSA-N
ChEBI ID
62226
mapping relation type
exact match
2 references
stated in
ChEBI release 2021-03-01
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H14N2O4Se/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1
27760
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H14N2O4Se/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1
DSSTox substance ID
DTXSID901168210
1 reference
matched by identifier from
InChIKey
InChIKey
ZNWYDQPOUQRDLY-WHFBIAKZSA-N
Human Metabolome Database ID
HMDB0006343
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZNWYDQPOUQRDLY-WHFBIAKZSA-N
UNII
X7WTF6263P
1 reference
matched by identifier from
InChIKey
InChIKey
ZNWYDQPOUQRDLY-WHFBIAKZSA-N
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