Mol:LBF20107PG23
Copyright: ARM project http://www.metabolome.jp/
25 26 0 0 0 0 0 0 0 0999 V2000 2.2173 0.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9321 0.8216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6465 0.4089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9321 1.6465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5027 0.8216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7881 0.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0737 0.8215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6409 0.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3529 0.8201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 0.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8496 0.6639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3346 -0.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8496 -0.6710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -0.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3504 -0.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0761 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7881 -0.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5002 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2122 -0.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9243 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6363 -0.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0761 -1.6465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6465 0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6465 -0.4575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 0 1 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 10 9 1 6 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 10 1 0 14 15 1 1 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 17 23 1 6 11 24 1 6 13 25 1 6 24 25 1 0
S SKP 6 ID LBF20107PG23 FORMULA C18H30O5 EXACTMASS 326.20932407 AVERAGEMASS 326.4278 SMILES [C@@H]([C@@H]2CCCCCCC(O)=O)(O1)C[C@H]([C@@H]2C=C[C@H](O)CCC)O1 AUTODRAW FALSE M END
