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CHEBI:116916 - dCMP-dTMP

ChEBI IDCHEBI:116916
ChEBI NamedCMP-dTMP
Stars
DefinitionA cyclobutadipyrimidine bis(deoxyribonucleotide) obtained by formal cyclodimerisation of 2'-deoxycytidine 5'-monophosphate and thymidine 5'-monophosphate.
Last Modified14 April 2016
DownloadsMolfile
FormulaC19H29N5O15P2
Net Charge0
Average Mass629.409
Monoisotopic Mass629.11354
SMILESCC12C(=O)NC(=O)N([C@H]3C[C@H](O)[C@@H](COP(=O)(O)O)O3)C1C1C2C(N)=NC(=O)N1[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1
InChIInChI=1S/C19H29N5O15P2/c1-19-12-13(23(17(28)21-15(12)20)10-2-6(25)8(38-10)4-36-40(30,31)32)14(19)24(18(29)22-16(19)27)11-3-7(26)9(39-11)5-37-41(33,34)35/h6-14,25-26H,2-5H2,1H3,(H2,20,21,28)(H,22,27,29)(H2,30,31,32)(H2,33,34,35)/t6-,7-,8+,9+,10+,11+,12?,13?,14?,19?/m0/s1
InChIKeyNMGZVJDQABHTSU-KJHCXILBSA-N
Species of MetaboliteComponentSourceComments
Mycoplasma genitalium (ncbitaxon:2097) - PubMed (22817898)
Roles Classification
Biological Role:
Mycoplasma genitalium metabolite  Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
ChEBI Ontology
Outgoing Relation(s)
dCMP-dTMP (CHEBI:116916) has role Mycoplasma genitalium metabolite (CHEBI:131604)
dCMP-dTMP (CHEBI:116916) is a cyclobutadipyrimidine bis(deoxyribonucleotide) (CHEBI:18326)
IUPAC Name 
5-amino-1,8-bis(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-4a-methyl-1,4a,4b,8,8a,8b-hexahydrocyclobuta[1,2-d:4,3-d']dipyrimidine-2,4,7(3H)-trione
Citations