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dTDP-alpha-D-glucose

PropertiesImage
MNX_IDMNXM1105949 Image of MNXM1105949
referencechebi:57477
formulaC16H24N2O16P2
global charge-2
mol weight562.314
InChIKeyYSYKRGRSMLTJNL-URARBOGNSA-L
InChIInChI=1S/C16H26N2O16P2/c1-6-3-18(16(25)17-14(6)24)10-2-7(20)9(31-10)5-30-35(26,27)34-36(28,29)33-15-13(23)12(22)11(21)8(4-19)32-15/h3,7-13,15,19-23H,2,4-5H2,1H3,(H,26,27)(H,28,29)(H,17,24,25)/p-2/t7-,8+,9+,10+,11+,12-,13+,15+/m0/s1
SMILESCc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)[nH]c1=O
MNX internals
InChI (mnx)InChI=1/C16H26N2O16P2/c1-6-3-18(16(25)17-14(6)24)10-2-7(20)9(31-10)5-30-35(26,27)34-36(28,29)33-15-13(23)12(22)11(21)8(4-19)32-15/h3,7-13,15,19-23H,2,4-5H2,1H3,(H,26,27)(H,28,29)(H,17,24,25)/t7-,8+,9+,10+,11+,12-,13+,15+/m0/s1 Image of MNXM1105949
SMILES (mnx)[C@H:1]1([CH:2]2[C:5](=[CH2:10])[CH2:9][C:12](=[O:23])[O:24]([OH:25])=[CH:6]2)[CH2:3][C@@H:7]([O:22][O:21][O:20]([CH2:14][O:19]([CH2:13][O@:31]2[O:33][O@:30]([PH:35][PH2:36])[O@@:28]([OH:29])[O@:26]([OH:27])[O@:34]2[OH:32])(=[CH2:15])[CH3:16])(=[NH:17])[NH2:18])[C@H:8]([CH3:11])[CH2:4]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)17
in models (compartimentalized) 8
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57477
chebi:57477
YSYKRGRSMLTJNL-URARBOGNSA-L 		dTDP-alpha-D-glucose
dTDP-alpha-D-glucose(2-)
dTDP-glucose dianion
dTDP-glucose(2-)
thymidine 5'-[3-(alpha-D-glucopyranosyl) diphosphate]

bigg.metabolite:dtdpglu
biggM:dtdpglu
YSYKRGRSMLTJNL-KFQCIAAJSA-L 		DTDPglucose

sabiork.compound:29110
sabiorkM:29110
YSYKRGRSMLTJNL-KFQCIAAJSA-N 		TDPglucose

sabiork.compound:1534
sabiorkM:1534
YSYKRGRSMLTJNL-KFQCIAAJSA-N 		dTDP-D-glucose
hmdb:HMDB0001328
YSYKRGRSMLTJNL-URARBOGNSA-N 		dTDP-D-glucose
2'Deoxy-thymidine-5'-diphospho-a-D-glucose
2'Deoxy-thymidine-5'-diphospho-alpha-D-glucose
DTDPglucose
Deoxythymidine diphosphate-glucose
TDP-D-glucose
TDP-Glc
TDP-alpha-D-glucose
TDP-glucose
TDPG
Thymidine 5'-diphosphate-D-glucose
Thymidine 5'-diphosphoglucose
Thymidine 5'-pyrophosphate alpha-D-glucosyl ester
Thymidine diphosphate alpha-D-glucose
Thymidine pyrophosphate alpha-D-glucopyranosyl ester
alpha-D-Glucose-1-TDP
dTDP-D-Glucose
dTDP-a-D-Glucose
dTDP-alpha-D-Glucose
dTDP-alpha-D-glucose
dtdp-glucose
{[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy}({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphinic acid

CHEBI:35248
chebi:35248
YSYKRGRSMLTJNL-KFQCIAAJSA-N 		dTDP-D-glucose
thymidine 5'-[3-(D-glucopyranosyl) dihydrogen diphosphate]
hmdb:HMDB0304344
YSYKRGRSMLTJNL-URARBOGNSA-L 		dTDP-alpha-D-glucose
1-[(2R,4S,5R)-4-hydroxy-5-({[hydroxy({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})phosphoryl phosphonato]oxy}methyl)oxolan-2-yl]-5-methyl-2-oxo-1,2-dihydropyrimidin-4-olate
1-[(2R,4S,5R)-4-hydroxy-5-[({hydroxy[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphosphoryl phosphonato}oxy)methyl]oxolan-2-yl]-5-methyl-2-oxopyrimidin-4-olate
Deoxythymidine diphosphate-glucose
dTDP-Glucose
dTDP-Glucose dianion
dTDP-Glucose(2-)
dTDP-a-D-Glucose
dTDP-a-D-Glucose(2-)
dTDP-alpha-D-Glucose
dTDP-alpha-D-glucose(2-)

metacyc.compound:DTDP-D-GLUCOSE
metacycM:DTDP-D-GLUCOSE
YSYKRGRSMLTJNL-URARBOGNSA-L 		dTDP-alpha-D-glucose
TDP-glucose
dTDP-D-glucose
dTDP-glucose
thymidine-5'-diphospho-alpha-D-glucose

CHEBI:15700
chebi:15700
YSYKRGRSMLTJNL-URARBOGNSA-N 		dTDP-alpha-D-glucose
dTDP-D-glucose
dTDPglucose
thymidine 5'-[3-(alpha-D-glucopyranosyl) dihydrogen diphosphate]

vmhM:dtdpglu
vmhM:dtdpglu
vmhmetabolite:dtdpglu
vmhmetabolite:dtdpglu
YSYKRGRSMLTJNL-KFQCIAAJSA-L 		dTDP-glucose(2-)
{[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy}({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan

kegg.compound:C00842
keggC:C00842
YSYKRGRSMLTJNL-URARBOGNSA-N 		dTDP-glucose
dTDP-D-glucose
dTDP-alpha-D-glucose

sabiork.compound:3923
sabiorkM:3923
YSYKRGRSMLTJNL-URARBOGNSA-N 		dTDPglucose

seed.compound:cpd00626
seedM:cpd00626
YSYKRGRSMLTJNL-URARBOGNSA-L 		dTDPglucose
TDP-glucose
dTDP-D-glucose
dTDP-alpha-D-glucose
dTDP-glucose
dtdpglu

hmdb:HMDB01328
chebi:10526
chebi:10528
chebi:14089
chebi:14091
chebi:23556
biggM:M_dtdpglu
keggC:M_C00842
seedM:M_cpd00626
vmhM:M_dtdpglu 		secondary/obsolete/fantasy identifier