3,4,4-trihydroxy-5-phosphooxypentan-2-one

Properties Image MNX_ID MNXM14469 reference metacycM:CPD0-2468 formula C5H9O8P global charge -2 mol weight 228.093 InChIKey RKCAPQYKXONRSI-UHFFFAOYSA-L InChI InChI=1S/C5H11O8P/c1-3(6)4(7)5(8,9)2-13-14(10,11)12/h4,7-9H,2H2,1H3,(H2,10,11,12)/p-2 SMILES CC(=O)C(O)C(O)(O)COP(=O)([O-])[O-] MNX internals InChI (mnx) InChI=1/C5H11O8P/c1-3(6)4(7)5(8,9)2-13-14(10,11)12/h4,7-9H,2H2,1H3,(H2,10,11,12)/t4? SMILES (mnx) [CH3:1][C:3]([CH:4]([C:5]([CH2:2][O:13][P:14]([OH:10])([OH:11])=[O:12])([OH:8])[OH:9])[OH:7])=[O:6]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0