CMP-N,N'-diacetyllegionaminate

CMP-<i>N</i>,<i>N</i>'-diacetyllegionaminate




Chemical Formula:
C22H32N5O15P
Molecular Weight:
637.493 Daltons
Monoisotopic Mass:
639.1789019589 Daltons
SMILES:
CC(O)C(NC(=O)C)[CH]3(C(NC(=O)C)C(CC(C([O-])=O)(OP(OCC1(C(C(C(O1)N2(C=CC(=NC2=O)N))O)O))([O-])=O)O3)O)
InChI:
1S/C22H34N5O15P/c1-8(28)14(24-9(2)29)18-15(25-10(3)30)11(31)6-22(41-18,20(34)35)42-43(37,38)39-7-12-16(32)17(33)19(40-12)27-5-4-13(23)26-21(27)36/h4-5,8,11-12,14-19,28,31-33H,6-7H2,1-3H3,(H,24,29)(H,25,30)(H,34,35)(H,37,38)(H2,23,26,36)/p-2/t8-,11+,12-,14-,15-,16-,17-,18+,19-,22-/m1/s1
InChIKey:
XTZJKGIMUFZFBV-QBAABWDMSA-L

Synonyms
  • CMP-N,N'-diacetyllegionaminic acid

Databases
MetaCyc:  CPD-13167
PubChem (CID):  70678952
ChEBI:  68670
Seed:  cpd23764
MetaNetX:  MNXM16758
KEGG:  C20419