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CHEBI:58541 - 5-methyldeoxycytidine 5'-diphosphate(3−)

ChEBI IDCHEBI:58541
ChEBI Name5-methyldeoxycytidine 5'-diphosphate(3−)
Stars
ASCII Name5-methyldeoxycytidine 5'-diphosphate(3-)
DefinitionConjugate base of 5-methyldeoxycytidine 5'-(trihydrogen diphosphate).
Last Modified13 November 2017
DownloadsMolfile
FormulaC10H14N3O10P2
Net Charge-3
Average Mass398.181
Monoisotopic Mass398.01709
SMILESCc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])[O-])O2)c(=O)nc1N
InChIInChI=1S/C10H17N3O10P2/c1-5-3-13(10(15)12-9(5)11)8-2-6(14)7(22-8)4-21-25(19,20)23-24(16,17)18/h3,6-8,14H,2,4H2,1H3,(H,19,20)(H2,11,12,15)(H2,16,17,18)/p-3/t6-,7+,8+/m0/s1
InChIKeySHFOWZBOBJJZAP-XLPZGREQSA-K
ChEBI Ontology
Outgoing Relation(s)
5-methyldeoxycytidine 5'-diphosphate(3−) (CHEBI:58541) is a organophosphate oxoanion (CHEBI:58945)
5-methyldeoxycytidine 5'-diphosphate(3−) (CHEBI:58541) is conjugate base of 5-methyldeoxycytidine 5'-(trihydrogen diphosphate) (CHEBI:27964)
Incoming Relation(s)
5-methyldeoxycytidine 5'-(trihydrogen diphosphate) (CHEBI:27964) is conjugate acid of 5-methyldeoxycytidine 5'-diphosphate(3−) (CHEBI:58541)
IUPAC Name 
2'-deoxy-5-methyl-5'-O-[(phosphonatooxy)phosphinato]cytidine
UniProt Name  Source
5-methyldeoxycytidine diphosphateUniProt