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3'-deoxy-3',4'-didehydro-CTP

PropertiesImage
MNX_IDMNXM1128486 Image of MNXM1128486
referencechebi:166821
formulaC9H10N3O13P3
global charge-4
mol weight461.109
InChIKeyDGUQXKKDZHTKIE-HTRCEHHLSA-J
InChIInChI=1S/C9H14N3O13P3/c10-7-1-2-12(9(14)11-7)8-6(13)3-5(23-8)4-22-27(18,19)25-28(20,21)24-26(15,16)17/h1-3,6,8,13H,4H2,(H,18,19)(H,20,21)(H2,10,11,14)(H2,15,16,17)/p-4/t6-,8-/m1/s1
SMILESNC1=NC(=O)N([C@@H]2OC(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])=C[C@H]2O)C=C1
MNX internals
InChI (mnx)InChI=1/C9H14N3O13P3/c10-7-1-2-12(9(14)11-7)8-6(13)3-5(23-8)4-22-27(18,19)25-28(20,21)24-26(15,16)17/h1-3,6,8,13H,4H2,(H,18,19)(H,20,21)(H2,10,11,14)(H2,15,16,17)/t6-,8-/m1/s1 Image of MNXM1128486
SMILES (mnx)[CH:1]1=[CH:2][N:12]([C@H:8]2[C@H:6]([OH:13])[CH:3]=[C:5]([CH2:4][O:22][P:27]([OH:18])(=[O:19])[O:25][P:28]([OH:20])(=[O:21])[O:24][P:26]([OH:15])([OH:16])=[O:17])[O:23]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)1
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:166821
chebi:166821
DGUQXKKDZHTKIE-HTRCEHHLSA-J 		3'-deoxy-3',4'-didehydro-CTP
({[(4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-4,5-dihydrofuran-2-yl]methylphosphonato}oxy)(phosphonatooxy)phosphinate
3'-deoxy-3',4'-didehydro-CTP tetranion
3'-deoxy-3',4'-didehydro-CTP(4-)
ddh-CTP tetraanion
ddh-CTP(4-)
ddhCTP tetraanion
ddhCTP(4-)

CHEBI:156336
chebi:156336
DGUQXKKDZHTKIE-HTRCEHHLSA-N 		3'-deoxy-3',4'-didehydro-CTP
({[({[(4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-4,5-dihydrofuran-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
3'-deoxy-3',4'-didehydro-cytidine triphosphate
3'-deoxy-3',4'-didehydro-cytidine-5'-triphosphate
[[(2R,3R)-2-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxy-2,3-dihydrofuran-5-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
ddh-CTP
ddhC-triphosphate
ddhCTP