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Concept information

Preferred term

2'-deoxycytidine-thymidine dimer  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C19H27N5O9

inchi

  • InChI=1S/C19H27N5O9/c1-19-12-13(23(17(30)21-15(12)20)10-2-6(27)8(4-25)32-10)14(19)24(18(31)22-16(19)29)11-3-7(28)9(5-26)33-11/h6-14,25-28H,2-5H2,1H3,(H2,20,21,30)(H,22,29,31)/t6-,7-,8+,9+,10+,11+,12?,13?,14?,19?/m0/s1

inchikey

  • RLQGXMDNSAWICR-KJHCXILBSA-N

mass

  • 469.447

monoisotopicmass

  • 469.18088

smiles

  • C12C(C3(C1N(C(NC3=O)=O)[C@@H]4O[C@@H]([C@H](C4)O)CO)C)C(=NC(N2[C@@H]5O[C@@H]([C@H](C5)O)CO)=O)N

subset

  • 3_STAR

synonym EXACT

  • 5-amino-1,8-bis(2-deoxy-beta-D-erythro-pentofuranosyl)-4a-methyl-1,4a,4b,8,8a,8b-hexahydrocyclobuta[1,2-d:4,3-d']dipyrimidine-2,4,7(3H)-trione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116810

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