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CHEBI:15877 - L-lupinate

ChEBI IDCHEBI:15877
ChEBI NameL-lupinate
Stars
ASCII NameL-lupinate
Secondary ChEBI IDsCHEBI:14535, CHEBI:25082
Last Modified15 January 2019
DownloadsMolfile
FormulaC13H17N6O3
Net Charge-1
Average Mass305.318
Monoisotopic Mass305.13676
SMILESC/C(=C\CNc1ncnc2c1ncn2C[C@H](N)C(=O)[O-])CO
InChIInChI=1S/C13H18N6O3/c1-8(5-20)2-3-15-11-10-12(17-6-16-11)19(7-18-10)4-9(14)13(21)22/h2,6-7,9,20H,3-5,14H2,1H3,(H,21,22)(H,15,16,17)/p-1/b8-2+/t9-/m0/s1
InChIKeyLJJHXRRUVASJDX-WWQRDVDESA-M
ChEBI Ontology
Outgoing Relation(s)
L-lupinate (CHEBI:15877) is a L-α-amino acid anion (CHEBI:59814)
L-lupinate (CHEBI:15877) is conjugate base of L-lupinic acid (CHEBI:6572)
L-lupinate (CHEBI:15877) is conjugate base of L-lupinic acid zwitterion (CHEBI:58927)
Incoming Relation(s)
L-lupinic acid (CHEBI:6572) is conjugate acid of L-lupinate (CHEBI:15877)
L-lupinic acid zwitterion (CHEBI:58927) is conjugate acid of L-lupinate (CHEBI:15877)
IUPAC Name 
3-{6-[(2E)-4-hydroxy-3-methylbut-2-en-1-ylamino]-9H-purin-9-yl}-L-alaninate
Synonyms  Source
3-[N6-(4-hydroxyisopentenyl)adeninyl]-L-alaninateChEBI
(S)-2-amino-3-{[(E)-4-hydroxy-3-methylbut-2-enylamino]purin-9-yl}propanoateChEBI
Manual XrefsDatabases
C01513KEGG COMPOUND