Mol:FL2F19NC0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 36 40 0 0 0 0 0 0 0 0999 V2000 -0.0998 -0.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6128 -0.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0966 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6202 -1.8635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3328 -1.4478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3291 -0.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0491 -1.8572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7617 -1.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7581 -0.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0418 -0.2072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 -0.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1279 -0.6454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8408 -0.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8376 0.5948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1215 1.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4087 0.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0502 -2.5004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8158 -0.2194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6128 0.6321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2803 1.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0253 1.9016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2003 1.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0546 1.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6434 0.7770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3579 2.0145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3579 1.1895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0724 0.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3608 2.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2977 2.3996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7645 1.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4118 0.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1263 1.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8408 0.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8408 -0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1263 -0.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4118 -0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 2 1 0 0 0 0 5 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 6 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 7 17 2 0 0 0 0 1 18 1 0 0 0 0 19 2 1 6 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 19 1 0 0 0 0 23 24 1 6 0 0 0 24 26 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 22 28 1 0 0 0 0 22 29 1 0 0 0 0 27 30 2 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 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 31 1 0 0 0 0 S SKP 8 ID FL2F19NC0003 KNApSAcK_ID C00014302 NAME (+)-Tephrorin B;Tephrorin B CAS_RN 261767-63-9 FORMULA C30H28O6 EXACTMASS 484.188588628 AVERAGEMASS 484.53972000000005 SMILES O(C(c(c5)cccc5)1)c(c2C(C3)C(OC(=O)C=Cc(c4)cccc4)C(O3)(C)C)c(ccc2O)C(=O)C1 M END