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> Main
CHEBI:131821 - thymidine 5'-monophosphate dimer
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ChEBI Name
thymidine 5'-monophosphate dimer
ChEBI ID
CHEBI:131821
Definition
A cyclobutadipyrimidine bis(deoxyribonucleotide) obtained by formal cyclodimerisation of thymidine 5'-monophosphate.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C20H30N4O16P2
Net Charge
0
Average Mass
644.418
Monoisotopic Mass
644.11320
InChI
InChI=1S/C20H30N4O16P2/c1-
19-
13(23(17(29)
21-
15(19)
27)
11-
3-
7(25)
9(39-
11)
5-
37-
41(31,32)
33)
14-
20(19,2)
16(28)
22-
18(30)
24(14)
12-
4-
8(26)
10(40-
12)
6-
38-
42(34,35)
36/h7-
14,25-
26H,3-
6H2,1-
2H3,(H,21,27,29)
(H,22,28,30)
(H2,31,32,33)
(H2,34,35,36)
/t7-
,8-
,9+,10+,11+,12+,13?,14?,19?,20?/m0/s1
InChIKey
WJOJPAAQGGVHBJ-DXKBKMAZSA-N
SMILES
C12N(C(NC(C1(C)
C3(C2N(C(NC3=O)
=O)
[C@@H]
4O[C@@H]
([C@H]
(C4)
O)
COP(=O)
(O)
O)
C)
=O)
=O)
[C@@H]
5O[C@@H]
([C@H]
(C5)
O)
COP(=O)
(O)
O
Metabolite of Species
Details
Mycoplasma genitalium
(NCBI:txid2097)
See:
PubMed
Roles Classification
Biological Role
(s):
Mycoplasma genitalium metabolite
Any bacterial metabolite produced during a metabolic reaction in
Mycoplasma genitalium
.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
thymidine 5'-monophosphate dimer (
CHEBI:131821
)
has role
Mycoplasma genitalium
metabolite (
CHEBI:131604
)
thymidine 5'-monophosphate dimer (
CHEBI:131821
)
is a
cyclobutadipyrimidine bis(deoxyribonucleotide) (
CHEBI:18326
)
IUPAC Name
1,8-
bis(2-
deoxy-
5-
O
-
phosphono-
β-
D
-
erythro
-
pentofuranosyl)-
4a,4b-
dimethylhexahydrocyclobuta[1,2-
d
:4,3-
d
']dipyrimidine-
2,4,5,7(3
H
,6
H
)-
tetrone
Synonyms
Sources
cyclobutane_dTMPdTMP
ChEBI
dTMP dimer
ChEBI
thymidine 5'-monophosphate dimer
ChEBI
Citation
Type
Source
22817898
PubMed citation
Europe PMC
Last Modified
21 April 2016