Mol:FLIDHXNI0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 28 0 0 0 0 0 0 0 0999 V2000 -1.4496 1.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4496 0.4797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 0.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 0.4797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 1.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 1.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 0.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 0.4797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7756 1.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2193 1.4432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 -0.5282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 -0.5282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9265 0.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2252 -0.5279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0059 1.4432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1155 -0.8712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3317 0.8008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 -0.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 -1.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1155 -0.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 11 2 0 0 0 0 7 17 1 0 0 0 0 1 2 1 0 0 0 0 18 1 1 0 0 0 0 12 17 1 0 0 0 0 14 19 1 0 0 0 0 8 20 1 0 0 0 0 2 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 S SKP 8 ID FLIDHXNI0003 KNApSAcK_ID C00009688 NAME Glyceocarpin;Glyceollidin II;3,6a,9-Trihydroxy-2-prenylpterocarpan CAS_RN 77979-22-7 FORMULA C20H20O5 EXACTMASS 340.13107375 AVERAGEMASS 340.3698 SMILES C(C(O)42)Oc(c(C2Oc(c43)cc(O)cc3)1)cc(O)c(c1)CC=C(C)C M END