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ddCTP

PropertiesImage
MNX_IDMNXM155320 Image of MNXM155320
referencesabiorkM:21201
formulaC9H16N3O12P3
global charge0
mol weight451.158
InChIKeyARLKCWCREKRROD-POYBYMJQSA-N
InChIInChI=1S/C9H16N3O12P3/c10-7-3-4-12(9(13)11-7)8-2-1-6(22-8)5-21-26(17,18)24-27(19,20)23-25(14,15)16/h3-4,6,8H,1-2,5H2,(H,17,18)(H,19,20)(H2,10,11,13)(H2,14,15,16)/t6-,8+/m0/s1
SMILESN=C1C=CN([C@H]2CC[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C(O)=N1
MNX internals
InChI (mnx)InChI=1/C9H16N3O12P3/c10-7-3-4-12(9(13)11-7)8-2-1-6(22-8)5-21-26(17,18)24-27(19,20)23-25(14,15)16/h3-4,6,8H,1-2,5H2,(H,17,18)(H,19,20)(H2,10,11,13)(H2,14,15,16)/t6-,8+/m0/s1 Image of MNXM155320
SMILES (mnx)[CH2:1]1[CH2:2][C@H:8]([N:12]2[CH:4]=[CH:3][C:7](=[NH:10])[N:11]=[C:9]2[OH:13])[O:22][C@@H:6]1[CH2:5][O:21][P:26]([OH:17])(=[O:18])[O:24][P:27]([OH:19])(=[O:20])[O:23][P:25]([OH:14])([OH:15])=[O:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

sabiork.compound:21201
sabiorkM:21201
ARLKCWCREKRROD-POYBYMJQSA-N 		ddCTP
hmdb:HMDB0061726
ARLKCWCREKRROD-POYBYMJQSA-N 		Dideoxycytidine 5'-Triphosphate
2',3'-DDCTP
2',3'-DIDEOXYCYTIDINE 5'-triphosphoric acid
2',3'-Dideoxycytidine 5'-triphosphate
2'3'-Dideoxycytidine 5'-triphosphate
2'3'-Dideoxycytidine 5'-triphosphoric acid
DDCTP-2',3'
Dideoxycytidine 5'-triphosphoric acid
[hydroxy({hydroxy[(2S,5R)-5-(2-hydroxy-4-iminopyrimidin-1-yl)oxolan-2-yl]methoxyphosphoryl}oxy)phosphoryl]oxyphosphonic acid
{[hydroxy({[hydroxy({[(2S,5R)-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy})phosphoryl]oxy}phosphonic acid

hmdb:HMDB61726 		secondary/obsolete/fantasy identifier