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ddTMP

PropertiesImage
MNX_IDMNXM1101267 Image of MNXM1101267
referencechebi:145468
formulaC10H13N2O7P
global charge-2
mol weight304.195
InChIKeyWVNRRNJFRREKAR-JGVFFNPUSA-L
InChIInChI=1S/C10H15N2O7P/c1-6-4-12(10(14)11-9(6)13)8-3-2-7(19-8)5-18-20(15,16)17/h4,7-8H,2-3,5H2,1H3,(H,11,13,14)(H2,15,16,17)/p-2/t7-,8+/m0/s1
SMILESCC1=CN([C@H]2CC[C@@H](COP(=O)([O-])[O-])O2)C(=O)NC1=O
MNX internals
InChI (mnx)InChI=1/C10H15N2O7P/c1-6-4-12(10(14)11-9(6)13)8-3-2-7(19-8)5-18-20(15,16)17/h4,7-8H,2-3,5H2,1H3,(H,11,13,14)(H2,15,16,17)/t7-,8+/m0/s1 Image of MNXM1101267
SMILES (mnx)[CH3:1][C:6]1=[CH:4][N:12]([C@H:8]2[CH2:3][CH2:2][C@@H:7]([CH2:5][O:18][P:20]([OH:15])([OH:16])=[O:17])[O:19]2)[C:10](=[O:14])[N:11]=[C:9]1[OH:13]
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:145468
chebi:145468
WVNRRNJFRREKAR-JGVFFNPUSA-L 		ddTMP
2',3'-dideoxythymidine 5'-phosphate(2-)
ddTMP(2-)
hmdb:HMDB0250899
WVNRRNJFRREKAR-UHFFFAOYSA-N 		3'-Deoxythymidine-5'-monophosphate
3'-Deoxythymidine-5'-monophosphoric acid
[5-(5-methyl-2,4-dioxo-3H-pyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid
{[5-(4-hydroxy-5-methyl-2-oxo-1,2-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphonate
{[5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphonic acid

seed.compound:cpd33483
seedM:cpd33483
WVNRRNJFRREKAR-JGVFFNPUSA-L 		ddTMP
dideoxythymidylate

metacyc.compound:CPD-18527
metacycM:CPD-18527
WVNRRNJFRREKAR-JGVFFNPUSA-L 		dideoxythymidylate
ddTMP

seedM:M_cpd33483 		secondary/obsolete/fantasy identifier