α-D-ribose 1-(acetamidomethylphosphonate) 5-triphosphate

Chemical Formula:

C₈H₁₄NO₁₇P₄

Molecular Weight:

520.09 Daltons

Monoisotopic Mass:

524.9603442308 Daltons

SMILES:

CC(=O)NCP([O-])(=O)OC1(C(C(C(O1)COP([O-])(OP([O-])(=O)OP(=O)([O-])[O-])=O)O)O)

InChI:

1S/C8H19NO17P4/c1-4(10)9-3-27(13,14)24-8-7(12)6(11)5(23-8)2-22-29(18,19)26-30(20,21)25-28(15,16)17/h5-8,11-12H,2-3H2,1H3,(H,9,10)(H,13,14)(H,18,19)(H,20,21)(H2,15,16,17)/p-5/t5-,6-,7-,8-/m1/s1

InChIKey:

UJJCYPNOUDIVGM-WCTZXXKLSA-I

Synonyms

5-triphospho-α-D-ribosyl-1-(2-N-acetamidomethylphosphonate)

Databases

MetaCyc: CPD-19235

PubChem (CID): 122706418

MetaNetX: MNXM164514