CHEBI:91255 - CMP-5'-phosphonoformate(3−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name CMP-5'-phosphonoformate(3−)
ChEBI ID CHEBI:91255
ChEBI ASCII Name CMP-5'-phosphonoformate(3-)
Definition An organophosphate oxoanion obtained by removal of three protons from CMP-5'-phosphonoformic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C10H12N3O12P2
Net Charge -3
Average Mass 428.163
Monoisotopic Mass 427.99127
InChI InChI=1S/C10H15N3O12P2/c11-5-1-2-13(9(16)12-5)8-7(15)6(14)4(24-8)3-23-27(21,22)25-26(19,20)10(17)18/h1-2,4,6-8,14-15H,3H2,(H,17,18)(H,19,20)(H,21,22)(H2,11,12,16)/p-3/t4-,6-,7-,8-/m1/s1
InChIKey UKMKGKZFTWPAOJ-XVFCMESISA-K
SMILES O=P(OP(C([O-])=O)(=O)[O-])([O-])OC[C@H]1O[C@@H](N2C(N=C(C=C2)N)=O)[C@@H]([C@@H]1O)O
ChEBI Ontology
Outgoing CMP-5'-phosphonoformate(3−) (CHEBI:91255) is a monocarboxylic acid anion (CHEBI:35757)
CMP-5'-phosphonoformate(3−) (CHEBI:91255) is a organophosphate oxoanion (CHEBI:58945)
CMP-5'-phosphonoformate(3−) (CHEBI:91255) is conjugate base of CMP-5'-phosphonoformic acid (CHEBI:131759)
Incoming CMP-5'-phosphonoformic acid (CHEBI:131759) is conjugate acid of CMP-5'-phosphonoformate(3−) (CHEBI:91255)
IUPAC Name
5'-O-{[(carboxylatophosphinato)oxy]phosphinato}cytidine
Synonym Source
CMP-5'-phosphonoformate UniProt
Manual Xref Database
CPD-11737 MetaCyc
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Citation Waiting for Citations Type Source
17632514 PubMed citation SUBMITTER
Last Modified
18 April 2016