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Substance Name: Cytidylyl-(5'.3')-guanylyl-(5'.3')-adenosine
RN: 4136-23-6
InChIKey: XFAGNUJNEBLEJP-PZFDTBOASA-N

Molecular Formula

  • C29-H37-N13-O18-P2

Molecular Weight

  • 917.6323
 
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Names and Synonyms

Synonym

  • EINECS 223-956-2

Systematic Name

  • Cytidylyl-(5'.3')-guanylyl-(5'.3')-adenosine

Registry Numbers

CAS Registry Number

  • 4136-23-6

System Generated Number

  • 0004136236

Structure Descriptors

InChI

1S/C29H37N13O18P2/c30-12-1-2-40(29(49)37-12)25-16(45)15(44)10(57-25)4-54-61(50,51)60-20-11(58-27(18(20)47)42-8-36-14-23(42)38-28(32)39-24(14)48)5-55-62(52,53)59-19-9(3-43)56-26(17(19)46)41-7-35-13-21(31)33-6-34-22(13)41/h1-2,6-11,15-20,25-27,43-47H,3-5H2,(H,50,51)(H,52,53)(H2,30,37,49)(H2,31,33,34)(H3,32,38,39,48)/t9-,10-,11-,15-,16-,17-,18-,19-,20-,25-,26-,27-/m0/s1

InChIKey

XFAGNUJNEBLEJP-PZFDTBOASA-N

Smiles

c1cn(c(=O)nc1N)[C@@H]2[C@H]([C@H]([C@@H](O2)COP(=O)(O)O[C@H]3[C@@H](O[C@@H]([C@H]3O)n4cnc5c4nc([nH]c5=O)N)COP(=O)(O)O[C@H]6[C@@H](O[C@@H]([C@H]6O)n7cnc8c7ncnc8N)CO)O)O