anserine

anserine




Chemical Formula:
C10H16N4O3
Molecular Weight:
240.261 Daltons
Monoisotopic Mass:
241.1300654328 Daltons
SMILES:
CN1(C=NC=C1CC(NC(CC[N+])=O)C([O-])=O)
InChI:
1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)/t8-/m0/s1
InChIKey:
MYYIAHXIVFADCU-QMMMGPOBSA-N

Synonyms
  • β-alanyl-Nπ-methyl-L-histidine

Databases
MetaCyc:  CPD-401
RefMet:  Anserine
MetaboLights:  MTBLC18323
HMDB:  HMDB00194
ChEBI:  58445
PubChem (CID):  6992114 112072
KEGG:  C01262
CAS:  584-85-0
Reactome:  8876775
Seed:  cpd00926
MetaNetX:  MNXM2639