Cas no 130036-24-7 (Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI))

Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI) structure
130036-24-7 structure
Product Name:Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI)
CAS No:130036-24-7
MF:C14H26N4O9P2
MW:456.325165271759
CID:178465
PubChem ID:122762
Update Time:2025-04-19

Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI) Chemical and Physical Properties

Names and Identifiers

    • Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI)
    • 2',3'-dideoxycytidine diphosphocholine
    • Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inn...
    • 2',3'-Dideoxycytidine 5'-(trihydrogen diphosphate) P-(2-(trimethylammonio)ethyl) ester, hydroxide, inner salt
    • Cytidine 5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P-(2-(trimethylammonio)ethyl) ester, hydroxide, inner salt
    • Ddcdp choline
    • ethanaminium, 2-[[[[[[5-(4-amino-2-oxo-1(2H)-pyrimidinyl)tetrahydro-2-furanyl]methoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-, inner salt
    • 2',3'-Dideoxycytidine, 5'-diphosphocholine-
    • 2-[[[5-(4-amino-2-oxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium
    • 130036-24-7
    • Inchi： 1S/C14H26N4O9P2/c1-18(2,3)8-9-24-28(20,21)27-29(22,23)25-10-11-4-5-13(26-11)17-7-6-12(15)16-14(17)19/h6-7,11,13H,4-5,8-10H2,1-3H3,(H3-,15,16,19,20,21,22,23)
    • InChI Key： NZCQWOIOZLKJHJ-UHFFFAOYSA-N
    • SMILES： P(=O)(O)(OP(=O)([O-])OCC[N+](C)(C)C)OCC1CCC(N2C(N=C(C=C2)N)=O)O1

Computed Properties

  • Exact Mass: 456.11768
  • Monoisotopic Mass: 456.118
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 10
  • Complexity: 758
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: _3.9
  • Topological Polar Surface Area: 173?2

Experimental Properties

  • Density: g/cm3
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 173.04

Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI) Related Literature

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130036-24-7 (Cytidine5'-(trihydrogen diphosphate), 2',3'-dideoxy-, P'-[2-(trimethylammonio)ethyl]ester, inner salt (9CI)) Related Products

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