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CHEBI:90945 - dTDP-4-ammonio-2,3,4,6-tetradeoxy-α-D-glucose(1−)

ChEBI IDCHEBI:90945
ChEBI NamedTDP-4-ammonio-2,3,4,6-tetradeoxy-α-D-glucose(1−)
Stars
ASCII NamedTDP-4-ammonio-2,3,4,6-tetradeoxy-alpha-D-glucose(1-)
DefinitionA nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups and protonation of the amino group of dTDP-4-amino-2,3,4,6-tetradeoxy-α-D-glucose; major species at pH 7.3.
Last Modified13 April 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC16H26N3O12P2
Net Charge-1
Average Mass514.341
Monoisotopic Mass514.09972
SMILESCc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])O[C@@H]3CC[C@H]([NH3+])[C@@H](C)O3)O2)c(=O)nc1=O
InChIInChI=1S/C16H27N3O12P2/c1-8-6-19(16(22)18-15(8)21)13-5-11(20)12(29-13)7-27-32(23,24)31-33(25,26)30-14-4-3-10(17)9(2)28-14/h6,9-14,20H,3-5,7,17H2,1-2H3,(H,23,24)(H,25,26)(H,18,21,22)/p-1/t9-,10+,11+,12-,13-,14-/m1/s1
InChIKeyQBCDCCNQCPTNSU-GSZZWUTPSA-M
ChEBI Ontology
Outgoing Relation(s)
dTDP-4-ammonio-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90945) is a nucleotide-sugar oxoanion (CHEBI:59737)
dTDP-4-ammonio-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90945) is conjugate base of dTDP-4-amino-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:81462)
Incoming Relation(s)
dTDP-4-amino-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:81462) is conjugate acid of dTDP-4-ammonio-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90945)
IUPAC Name 
5'-O-{[({[(2R,5S,6R)-5-azaniumyl-6-methyloxan-2-yl]oxy}phosphinato)oxy]phosphinato}thymidine
Synonym  Source
dTDP-4-ammonio-2,3,4,6-tetradeoxy-α-D-erythro-hexopyranose(1−)ChEBI
UniProt Name  Source
dTDP-4-amino-2,3,4,6-tetradeoxy-α-D-erythro-hexopyranoseUniProt
Manual XrefsDatabases
CPD-13383MetaCyc