N-acetyldemethylphosphinothricin adenylate

<i>N</i>-acetyldemethylphosphinothricin adenylate




Chemical Formula:
C16H22N6O11P2
Molecular Weight:
536.331 Daltons
Monoisotopic Mass:
538.0978286646999 Daltons
SMILES:
CC(=O)NC(C(OP(OCC3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))([O-])=O)=O)CC[PH](=O)[O-]
InChI:
1S/C16H24N6O11P2/c1-7(23)21-8(2-3-34(27)28)16(26)33-35(29,30)31-4-9-11(24)12(25)15(32-9)22-6-20-10-13(17)18-5-19-14(10)22/h5-6,8-9,11-12,15,24-25,34H,2-4H2,1H3,(H,21,23)(H,27,28)(H,29,30)(H2,17,18,19)/p-2/t8-,9+,11+,12+,15+/m0/s1
InChIKey:
MRUAZLYBBXUWJU-OPYVMVOTSA-L

Databases
MetaCyc:  CPD-18587
PubChem (CID):  102515190 138319207
MetaNetX:  MNXM164943