CHEBI:229206 - CMP-5'-(3-aminopropyl)phosphonate zwitterion

ChEBI IDCHEBI:229206
ChEBI NameCMP-5'-(3-aminopropyl)phosphonate zwitterion
Stars
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC12H21N4O10P2
Net Charge-1
Average Mass443.266
Monoisotopic Mass443.07384
SMILESNc1ccn([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])CCC[NH3+])[C@@H](O)[C@H]2O)c(=O)n1
InChIInChI=1S/C12H22N4O10P2/c13-3-1-5-27(20,21)26-28(22,23)24-6-7-9(17)10(18)11(25-7)16-4-2-8(14)15-12(16)19/h2,4,7,9-11,17-18H,1,3,5-6,13H2,(H,20,21)(H,22,23)(H2,14,15,19)/p-1/t7-,9-,10-,11-/m1/s1
InChIKeyOGKREJFVUHDHTP-QCNRFFRDSA-M
ChEBI Ontology
Outgoing Relation(s)
CMP-5'-(3-aminopropyl)phosphonate zwitterion (CHEBI:229206) is a organophosphate oxoanion (CHEBI:58945)
UniProt Name  Source
CMP-5'-(3-aminopropyl)phosphonateUniProt
Manual XrefsDatabases
CPD-15966MetaCyc
Citations