cytidine 5'-{[hydroxy(2-hydroxypropyl)phosphonoyl]phosphate}

cytidine 5'-{[hydroxy(2-hydroxypropyl)phosphonoyl]phosphate}




Chemical Formula:
C12H19N3O11P2
Molecular Weight:
443.243 Daltons
Monoisotopic Mass:
445.0651315528 Daltons
SMILES:
CC(O)CP([O-])(OP(OCC2(C(C(C(N1(C(N=C(C=C1)N)=O))O2)O)O))([O-])=O)=O
InChI:
1S/C12H21N3O11P2/c1-6(16)5-27(20,21)26-28(22,23)24-4-7-9(17)10(18)11(25-7)15-3-2-8(13)14-12(15)19/h2-3,6-7,9-11,16-18H,4-5H2,1H3,(H,20,21)(H,22,23)(H2,13,14,19)/p-2/t6?,7-,9-,10-,11-/m1/s1
InChIKey:
VQDRQBLAARRQFV-JANFQQFMSA-L

Synonyms
  • HPP-CMP
  • cytidylyl-2-hydroxypropylphosphonate
  • 2-hydroxyprophylphosphonate-CMP

Databases
MetaCyc:  CPD-21482
ChEBI:  142877
PubChem (CID):  134820194