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CHEBI:58927 - L-lupinic acid zwitterion

ChEBI IDCHEBI:58927
ChEBI NameL-lupinic acid zwitterion
Stars
ASCII NameL-lupinic acid zwitterion
DefinitionZwitterionic form of L-lupinic acid having an anionic carboxy group and a protonated nitrogen.
Last Modified1 December 2014
DownloadsMolfile
FormulaC13H18N6O3
Net Charge0
Average Mass306.326
Monoisotopic Mass306.14404
SMILESC/C(=C\CNc1ncnc2c1ncn2C[C@H]([NH3+])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)/b8-2+/t9-/m0/s1
InChIKeyLJJHXRRUVASJDX-WWQRDVDESA-N
ChEBI Ontology
Outgoing Relation(s)
L-lupinic acid zwitterion (CHEBI:58927) is a amino-acid zwitterion (CHEBI:35238)
L-lupinic acid zwitterion (CHEBI:58927) is conjugate acid of L-lupinate (CHEBI:15877)
L-lupinic acid zwitterion (CHEBI:58927) is tautomer of L-lupinic acid (CHEBI:6572)
Incoming Relation(s)
L-lupinate (CHEBI:15877) is conjugate base of L-lupinic acid zwitterion (CHEBI:58927)
L-lupinic acid (CHEBI:6572) is tautomer of L-lupinic acid zwitterion (CHEBI:58927)
IUPAC Name 
(2S)-2-azaniumyl-3-(6-{[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]amino}-9H-purin-9-yl)propanoate
UniProt Name  Source
L-lupinateUniProt