CHEBI:17228 - taurocyamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name taurocyamine
ChEBI ID CHEBI:17228
Definition The N-amidino derivative of taurine.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:9409, CHEBI:15198, CHEBI:26855
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Formula C3H9N3O3S
Net Charge 0
Average Mass 167.180
Monoisotopic Mass 167.03646
InChI InChI=1S/C3H9N3O3S/c4-3(5)6-1-2-10(7,8)9/h1-2H2,(H4,4,5,6)(H,7,8,9)
InChIKey JKLRIMRKZBSSED-UHFFFAOYSA-N
SMILES C(S(=O)(O)=O)CNC(=N)N
ChEBI Ontology
Outgoing taurocyamine (CHEBI:17228) has functional parent taurine (CHEBI:15891)
taurocyamine (CHEBI:17228) is a guanidines (CHEBI:24436)
taurocyamine (CHEBI:17228) is a organosulfonic acid (CHEBI:33551)
taurocyamine (CHEBI:17228) is tautomer of taurocyamine zwitterion (CHEBI:58064)
Incoming N-phosphotaurocyamine (CHEBI:16621) has functional parent taurocyamine (CHEBI:17228)
taurocyamine zwitterion (CHEBI:58064) is tautomer of taurocyamine (CHEBI:17228)
IUPAC Name
2-(carbamimidamido)ethanesulfonic acid
Synonyms Sources
2-{[amino(imino)methyl]amino}ethanesulfonic acid IUPAC
guanidinoethane sulfonic acid ChemIDplus
N-(aminoiminomethyl) taurine ChEBI
Taurocyamine KEGG COMPOUND
Manual Xrefs Databases
3S5 PDBeChem
C01959 KEGG COMPOUND
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Registry Numbers Types Sources
1775583 Beilstein Registry Number Beilstein
543-18-0 CAS Registry Number ChemIDplus
Last Modified
21 November 2019