CHEBI:90946 - dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−)

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ChEBI Name dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−)
ChEBI ID CHEBI:90946
ChEBI ASCII Name dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-alpha-D-glucose(1-)
Definition A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups and protonation of the amino group of dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C17H28N3O12P2
Net Charge -1
Average Mass 528.365
Monoisotopic Mass 528.11537
InChI InChI=1S/C17H29N3O12P2/c1-9-7-20(17(23)19-16(9)22)14-6-12(21)13(30-14)8-28-33(24,25)32-34(26,27)31-15-5-4-11(18-3)10(2)29-15/h7,10-15,18,21H,4-6,8H2,1-3H3,(H,24,25)(H,26,27)(H,19,22,23)/p-1/t10-,11+,12+,13-,14-,15-/m1/s1
InChIKey JRJYBKLGPOKTLS-YXJLRHLOSA-M
SMILES [C@@H]1(N2C(NC(=O)C(=C2)C)=O)O[C@H](COP(OP(O[C@H]3O[C@@H]([C@H](CC3)[NH2+]C)C)(=O)[O-])(=O)[O-])[C@H](C1)O
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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ChEBI Ontology
Outgoing dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90946) has role bacterial metabolite (CHEBI:76969)
dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90946) is a nucleotide-sugar oxoanion (CHEBI:59737)
dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90946) is conjugate base of dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:131522)
Incoming dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-glucose (CHEBI:131522) is conjugate acid of dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-glucose(1−) (CHEBI:90946)
IUPAC Name
5'-O-{[({[(2R,5S,6R)-6-methyl-5-(methylazaniumyl)oxan-2-yl]oxy}phosphinato)oxy]phosphinato}thymidine
Synonyms Sources
dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-α-D-erythro-hexopyranose UniProt
dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-α-D-erythro-hexopyranose(1−) ChEBI
dTDP-N-monodesmethyl-D-forosamine MetaCyc
Manual Xref Database
CPD-13389 MetaCyc
View more database links
Citation Waiting for Citations Type Source
18345667 PubMed citation SUBMITTER
Last Modified
18 March 2016