CHEBI:143224 - yersinopine(1−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name yersinopine(1−)
ChEBI ID CHEBI:143224
ChEBI ASCII Name yersinopine(1-)
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C13H19N4O6
Net Charge -1
Average Mass 327.318
Monoisotopic Mass 327.13101
InChI InChI=1S/C13H20N4O6/c1-7(11(18)19)17-9(12(20)21)2-3-15-10(13(22)23)4-8-5-14-6-16-8/h5-7,9-10,15,17H,2-4H2,1H3,(H,14,16)(H,18,19)(H,20,21)(H,22,23)/p-1/t7?,9-,10-/m0/s1
InChIKey WLNNYKMTYVPSDL-IVNRZZHDSA-M
SMILES N=1C(=CNC1)C[C@H]([NH2+]CC[C@H]([NH2+]C(C([O-])=O)C)C(=O)[O-])C(=O)[O-]
ChEBI Ontology
Outgoing yersinopine(1−) (CHEBI:143224) is a organic molecular entity (CHEBI:50860)
Synonym Source
yersinopine UniProt
Manual Xref Database
CPD-21435 MetaCyc accession
View more database links
Citation Waiting for Citations Type Source
29618515 PubMed citation SUBMITTER