Mol:LBF18109MO03
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
24 23 0 0 1 0 0 0 0 0999 V2000
-5.1811 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0072 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0557 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1040 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1524 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0703 0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0072 0.3805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5699 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1574 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3324 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9199 -1.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4685 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8810 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7060 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1185 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9436 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3560 1.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1811 1.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0007 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4132 0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4132 -1.0717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1040 0.3528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3895 0.7654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1524 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 24 1 0 0 0 0
3 6 1 4 0 0 0
2 7 1 4 0 0 0
1 8 1 0 0 0 0
2 11 1 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
5 12 1 4 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
18 17 1 4 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
4 22 1 4 0 0 0
22 23 1 0 0 0 0
5 24 2 0 0 0 0
S SKP 5
ID LBF18109MO03
FORMULA C19H36O5
EXACTMASS 344.256274262
AVERAGEMASS 344.48614000000003
SMILES CCCCCC(O)C(O)C(OC)C=CCCCCCCCC(O)=O
M END
