Mol:BMCCPTFOo007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 34 36 0 0 1 0 0 0 0 0999 V2000 3.7321 3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3301 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.2583 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 12 1 0 0 0 0 11 1 1 0 0 0 0 12 11 2 0 0 0 0 12 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 4 0 0 0 7 8 1 0 0 0 0 8 11 1 0 0 0 0 4 28 2 0 0 0 0 2 13 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 10 14 1 0 0 0 0 17 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 30 2 0 0 0 0 23 21 1 0 0 0 0 23 24 1 1 0 0 0 22 32 1 0 0 0 0 22 31 2 0 0 0 0 23 22 1 0 0 0 0 24 25 1 0 0 0 0 26 34 1 0 0 0 0 26 33 2 0 0 0 0 25 26 1 0 0 0 0 5 27 1 0 0 0 0 27 29 2 0 0 0 0 S SKP 7 ID BMCCPTFOo007 NAME 5-Formyl-tetrahydro-folic acid FORMULA C20H23N7O7 EXACTMASS 473.1658 AVERAGEMASS 473.4396 SMILES C(CNc(c3)ccc(C(N[C@H](CCC(O)=O)C(O)=O)=O)c3)(C2)N(C(=C(N2)1)C(NC(N)=N1)=O)C=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03479 M END