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ChEBI
> Main
CHEBI:90947 - dTDP-α-
D
-forosamine(1−)
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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.
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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
-
{[({[(2
R
,5
S
,6
R
)-
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