CHEBI:229214 - CMP-5'-(3-amino-3-carboxypropyl)phosphonate(2−)

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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 CMP-5'-(3-amino-3-carboxypropyl)phosphonate(2−)
ChEBI ID CHEBI:229214
ChEBI ASCII Name CMP-5'-(3-amino-3-carboxypropyl)phosphonate(2-)
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C13H20N4O12P2
Net Charge -2
Average Mass 486.268
Monoisotopic Mass 486.05639
InChI InChI=1S/C13H22N4O12P2/c14-6(12(20)21)2-4-30(23,24)29-31(25,26)27-5-7-9(18)10(19)11(28-7)17-3-1-8(15)16-13(17)22/h1,3,6-7,9-11,18-19H,2,4-5,14H2,(H,20,21)(H,23,24)(H,25,26)(H2,15,16,22)/p-2/t6?,7-,9-,10-,11-/m1/s1
InChIKey GWUKUUHZZNCSPS-JANFQQFMSA-L
SMILES C1=CC(=NC(N1[C@@H]2O[C@H](COP(OP([O-])(=O)CCC(C([O-])=O)[NH3+])(=O)[O-])[C@H]([C@H]2O)O)=O)N
ChEBI Ontology
Outgoing CMP-5'-(3-amino-3-carboxypropyl)phosphonate(2−) (CHEBI:229214) is a organophosphate oxoanion (CHEBI:58945)
Synonym Source
CMP-5'-(3-amino-3-carboxypropyl)phosphonate UniProt
Citation Waiting for Citations Type Source
20142041 PubMed citation SUBMITTER