Mol:FL6F1CNP0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 34 37 0 0 0 0 0 0 0 0999 V2000 -2.2354 0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2354 -0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6791 -0.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1228 -0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1228 0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6791 0.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5665 -0.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 -0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5665 0.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5459 0.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1129 -0.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6799 0.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6799 0.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1129 1.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5459 0.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7915 0.3261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2469 -0.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8138 0.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8138 0.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2469 1.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1129 1.9627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3192 1.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4748 0.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7915 -0.9584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3464 -0.6380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7915 -1.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4748 -1.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2366 -1.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1129 -0.6557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6797 -0.9830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6797 -1.6361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -1.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1141 -1.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 9 11 1 6 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 1 17 1 0 0 0 0 13 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 14 1 0 0 0 0 15 22 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 2 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 29 2 0 0 0 0 12 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 S SKP 8 ID FL6F1CNP0002 KNApSAcK_ID C00008788 NAME Kazinol H CAS_RN 104494-37-3 FORMULA C30H36O4 EXACTMASS 460.26135963999997 AVERAGEMASS 460.60444 SMILES c(c(C(C)(C)C=C)4)c(c3cc(O)4)CCC(O3)c(c1)c(CC=C(C)C)c(C=2)c(OC(C)(C)C2)c1O M END