Mol:BMAXS2AMS502
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 18 18 0 0 1 0 0 0 0 0999 V2000 4.3179 0.4071 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6270 1.3582 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6270 1.3582 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9360 0.4071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8870 0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3669 0.0981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -0.8800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 -1.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -0.1807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0392 2.1672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2147 2.1672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0949 -0.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 -1.1891 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 8.3550 -0.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 -2.1401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9971 -1.4981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -1.5492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 12 1 6 0 0 0 4 3 1 0 0 0 0 5 13 1 0 0 0 0 3 2 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 1 6 1 0 0 0 0 14 16 1 0 0 0 0 2 1 1 0 0 0 0 14 17 2 0 0 0 0 4 5 1 0 0 0 0 6 7 1 0 0 0 0 1 10 1 1 0 0 0 7 8 1 0 0 0 0 2 11 1 6 0 0 0 8 9 1 0 0 0 0 4 10 1 1 0 0 0 7 18 2 0 0 0 0 S SKP 7 NAME [(2R,5R) -5- [(2-Aminoacetyl) amino] -3,4-dihydroxyoxolan-2-yl] methyl dihydrogen phosphate CAS_RN 10074-18-7 ID BMAXS2AMS502 FORMULA C7H15N2O8P EXACTMASS 286.05660197599997 AVERAGEMASS 286.176441 SMILES NCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 SMILES NCC(=O)N[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 M END