Mol:LBF18108MO01
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 24 0 0 1 0 0 0 0 0999 V2000
-4.2968 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1232 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1716 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2200 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4590 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1232 2.3052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4589 2.3066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1734 2.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3523 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7648 0.8531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3523 0.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7648 -0.5758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3523 -1.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7648 -2.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3523 -2.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8843 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2968 2.2819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2968 0.8531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1814 2.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4669 2.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6857 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2733 0.8531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4483 0.8531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0358 0.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2200 1.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
3 25 1 0 0 0 0
4 5 1 0 0 0 0
2 6 1 4 0 0 0
5 7 1 0 0 0 0
7 8 1 0 0 0 0
5 9 1 4 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
15 14 1 4 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
16 18 1 0 0 0 0
3 19 1 4 0 0 0
19 20 1 0 0 0 0
1 21 1 0 0 0 0
2 24 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
4 25 2 0 0 0 0
S SKP 5
ID LBF18108MO01
FORMULA C20H38O5
EXACTMASS 358.271924326
AVERAGEMASS 358.51272
SMILES C(C(OC)C=CC(OC)CCCCCCCC(O)=O)(O)CCCCC
M END
