Mol:LBF20406LT05
Copyright: ARM project http://www.metabolome.jp/
27 26 0 0 0 0 0 0 0 0999 V2000 2.1937 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9084 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6228 -0.0007 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9084 1.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4791 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7646 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0526 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6594 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4844 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1989 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9108 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6228 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3348 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0468 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7588 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7588 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0443 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3299 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6154 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9009 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1864 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0526 1.2325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0468 1.2310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3348 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0468 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7588 0.4103 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 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 7 23 1 1 14 24 1 1 3 25 1 0 25 26 1 0 26 27 1 0
S SKP 6 ID LBF20406LT05 FORMULA C22H37NO4 EXACTMASS 379.27225867699997 AVERAGEMASS 379.53352 SMILES C(=CC[C@@H](O)C=CC=CC=C[C@H](CCCC(=O)NCCO)O)CCCCC AUTODRAW FALSE M END
