CHEBI:58927 - L-lupinic acid zwitterion

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ChEBI Name L-lupinic acid zwitterion ChEBI ID CHEBI:58927 ChEBI ASCII Name L-lupinic acid zwitterion Definition Zwitterionic form of L-lupinic acid having an anionic carboxy group and a protonated nitrogen. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C13H18N6O3 Net Charge 0 Average Mass 306.32040 Monoisotopic Mass 306.14404 InChI InChI=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 InChIKey LJJHXRRUVASJDX-WWQRDVDESA-N SMILES C\C(CO)=C/CNc1ncnc2n(C[C@H]([NH3+])C([O-])=O)cnc12 ChEBI Ontology Outgoing 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 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 Synonym Source L-lupinate UniProt Last Modified 01 December 2014