Mol:LBF22307PG09
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 27 27 0 0 0 0 0 0 0 0999 V2000 9.2937 3.8649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9847 2.9139 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7937 2.3261 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6028 2.9139 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2937 3.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7937 1.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0337 2.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2905 3.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3395 2.9650 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3884 2.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 3.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 3.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 3.6852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.3762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6598 0.8261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6598 -0.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5258 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5258 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3918 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3918 -3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0304 3.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2578 -4.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5538 2.6048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7059 4.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6485 2.0139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2578 -3.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5258 -3.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 1 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 2 7 1 1 0 0 0 6 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 4 23 1 6 0 0 0 3 6 1 6 0 0 0 9 25 1 6 0 0 0 9 21 1 1 0 0 0 1 24 1 6 0 0 0 20 26 1 0 0 0 0 20 27 2 0 0 0 0 26 22 1 0 0 0 0 S SKP 5 ID LBF22307PG09 FORMULA C22H38O5 EXACTMASS 382.271924326 AVERAGEMASS 382.53412000000003 SMILES C[C@@](O)(C=C[C@@H]([C@@H]1O)[C@H]([C@H](C1)O)CC=CCCCC(=O)OC)CCCCC M END