CHEBI:90947 - dTDP-α-D-forosamine(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name dTDP-α-D-forosamine(1−)
ChEBI ID CHEBI:90947
ChEBI ASCII Name dTDP-alpha-D-forosamine(1-)
Definition A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups and protonation of the amino group of dTDP-α-D-forosamine; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C18H30N3O12P2
Net Charge -1
Average Mass 542.392
Monoisotopic Mass 542.13102
InChI InChI=1S/C18H31N3O12P2/c1-10-8-21(18(24)19-17(10)23)15-7-13(22)14(31-15)9-29-34(25,26)33-35(27,28)32-16-6-5-12(20(3)4)11(2)30-16/h8,11-16,22H,5-7,9H2,1-4H3,(H,25,26)(H,27,28)(H,19,23,24)/p-1/t11-,12+,13+,14-,15-,16-/m1/s1
InChIKey XZDZLDKUTVVABQ-HIFUNWJGSA-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)[NH+](C)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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dTDP-α-D-forosamine(1−) (CHEBI:90947) has role bacterial metabolite (CHEBI:76969)
dTDP-α-D-forosamine(1−) (CHEBI:90947) is a nucleotide-sugar oxoanion (CHEBI:59737)
dTDP-α-D-forosamine(1−) (CHEBI:90947) is conjugate base of dTDP-α-D-forosamine (CHEBI:81463)
Incoming dTDP-α-D-forosamine (CHEBI:81463) is conjugate acid of dTDP-α-D-forosamine(1−) (CHEBI:90947)
IUPAC Name
5'-O-{[({[(2R,5S,6R)-5-(dimethylazaniumyl)-6-methyloxan-2-yl]oxy}phosphinato)oxy]phosphinato}thymidine
Synonym Source
dTDP-α-D-forosamine UniProt
Manual Xref Database
CPD-13384 MetaCyc
View more database links
Citation Type Source
18345667 PubMed citation SUBMITTER
Last Modified
18 March 2016