EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:235401 - Leu-His zwitterion

ChEBI IDCHEBI:235401
ChEBI NameLeu-His zwitterion
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC12H20N4O3
Net Charge0
Average Mass268.317
Monoisotopic Mass268.15354
SMILESCC(C)C[C@H]([NH3+])C(=O)N[C@@H](Cc1cncn1)C(=O)[O-]
InChIInChI=1S/C12H20N4O3/c1-7(2)3-9(13)11(17)16-10(12(18)19)4-8-5-14-6-15-8/h5-7,9-10H,3-4,13H2,1-2H3,(H,14,15)(H,16,17)(H,18,19)/t9-,10-/m0/s1
InChIKeyXWOBNBRUDDUEEY-UWVGGRQHSA-N
ChEBI Ontology
Outgoing Relation(s)
Leu-His zwitterion (CHEBI:235401) is a dipeptide zwitterion (CHEBI:90799)
Leu-His zwitterion (CHEBI:235401) is tautomer of Leu-His (CHEBI:74539)
Incoming Relation(s)
Leu-His (CHEBI:74539) is tautomer of Leu-His zwitterion (CHEBI:235401)