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2'-deoxycytidine 3'-monophosphate

MNXM148616 is deprecated and here replaced by MNXM729140
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM729140 Image of MNXM729140
referencechebi:233862
formulaC9H14N3O7P
global charge0
mol weight307.199
InChIKeyFVSAHFFHPOLBLL-UHFFFAOYSA-N
InChIInChI=1S/C9H14N3O7P/c10-7-1-2-12(9(14)11-7)8-3-5(6(4-13)18-8)19-20(15,16)17/h1-2,5-6,8,13H,3-4H2,(H2,10,11,14)(H2,15,16,17)
SMILESNC1=NC(=O)N(C2CC(OP(=O)(O)O)C(CO)O2)C=C1
MNX internals
InChI (mnx)InChI=1/C9H14N3O7P/c10-7-1-2-12(9(14)11-7)8-3-5(6(4-13)18-8)19-20(15,16)17/h1-2,5-6,8,13H,3-4H2,(H2,10,11,14)(H2,15,16,17)/t5?,6?,8? Image of MNXM729140
SMILES (mnx)[CH:1]1=[CH:2][N:12]([CH:8]2[CH2:3][CH:5]([O:19][P:20]([OH:15])([OH:16])=[O:17])[CH:6]([CH2:4][OH:13])[O:18]2)[C:9]([OH:14])=[N:11][C:7]1=[NH:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:233862
chebi:233862
FVSAHFFHPOLBLL-UHFFFAOYSA-N
2'-deoxycytidine 3'-monophosphate
[5-(4-amino-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
hmdb:HMDB0062545
FVSAHFFHPOLBLL-UHFFFAOYSA-N
2'-deoxycytidine 3'-monophosphate
2'-Deoxycytidine 3'-monophosphoric acid
[5-(2-hydroxy-4-iminopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxyphosphonic acid
{[5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonate
{[5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid

hmdb:HMDB62545
secondary/obsolete/fantasy identifier