chempirical

Polycytidylic acid

C9H14N3O8PCAS 30811-80-4323.20 g/mol

Open in Covalent MOL file
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AlcoholEtherPhenolPhosphate

Properties

Molecular formula
C9H14N3O8P
Molar mass
323.20 g/mol
Exact mass
323.0519 Da
Melting point
69 °C
logP
-2.20Crippen estimate
Polar surface area
178.3 Ų
H-bond donors / acceptors
6 / 8
Rotatable bonds
4
Stereocentres
R, R, S, Rin SMILES atom order

Identifiers

CAS number
30811-80-4
SMILES
N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1
InChIKey
IERHLVCPSMICTF-XVFCMESISA-N
InChI
InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • 5′-Cytidylic acid, homopolymer
  • 5′-Cytidylic acid, polymers
  • Poly(5′-cytidylic acid)
  • Poly(C)
  • Poly(cytidylic acid)
  • Poly(CMP)
  • NSC 120953

Work with Polycytidylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Cytidine triphosphate65-47-481 % similar Poly(I:C)24939-03-576 % similar Cytidine-5′-triphosphate disodium salt36051-68-074 % similar Disodium 5′-cytidylate6757-06-872 % similar Cytidine-5′-triphosphate sodium salt18423-42-272 % similar Deoxycytidine monophosphate1032-65-167 % similar Trisodium cytidine 5′-diphosphate34393-59-467 % similar Uridine monophosphate58-97-967 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Cytidine monophosphate63-37-6 3′-Cmp84-52-6 2′-Cytidylic acid85-94-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook