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Substance Name: 1-(3-Cytosinyl)-2-(1-guanyl)ethane
RN: 126175-83-5
InChIKey: VSFMTTSHQUVQPI-UHFFFAOYSA-N

Molecular Formula

  • C11-H12-N8-O2

Molecular Weight

  • 288.2698
 
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Names and Synonyms

Name of Substance

  • 1-(3-Cytosinyl)-2-(1-guanyl)ethane

Synonyms

  • 1-CGE
  • 2-Amino-1-(2-(3,6-dihydro-6-imino-2-oxo-1(2H)-pyrimidinyl)ethyl)- 1,7-dihydro-6H-purin-6-one

Systematic Name

  • 6H-Purin-6-one, 2-amino-1-(2-(3,6-dihydro-6-imino-2-oxo-1(2H)-pyrimidinyl)ethyl)- 1,7-dihydro-

Registry Numbers

CAS Registry Number

  • 126175-83-5

System Generated Number

  • 0126175835

Structure Descriptors

InChI

1S/C11H12N8O2/c12-6-1-2-14-11(21)18(6)3-4-19-9(20)7-8(16-5-15-7)17-10(19)13/h1-2,5,12H,3-4H2,(H2,13,17)(H,14,21)(H,15,16)

InChIKey

VSFMTTSHQUVQPI-UHFFFAOYSA-N

Smiles

c1c[nH]c(=O)n(c1=N)CCn2c(=O)c3c(nc[nH]3)nc2N