Mol:LBPR02010001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
63 63 0 0 0 0 0 0 0 0999 V2000
-13.6030 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-14.3180 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-14.3180 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-13.6030 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-12.8894 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-12.8894 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-13.6030 1.6514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-13.6030 -1.6514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-15.0330 -0.8264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-15.0330 0.8264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-12.1744 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-12.1744 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-11.4621 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.7485 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.0349 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.3212 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.6076 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8939 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1803 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.7485 1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8939 1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-15.8580 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-15.8580 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2906 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5762 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8617 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1472 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4327 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7183 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0038 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2893 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5749 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1396 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8541 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5686 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2830 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9975 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7120 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4264 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1409 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8554 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5699 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2843 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9988 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7133 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4277 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1422 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8567 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5712 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2856 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.0001 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7146 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.4290 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.1435 0.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.8580 0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8617 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0038 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8541 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7120 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5699 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4277 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2856 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.1435 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
1 6 1 0 0 0 0
1 7 2 0 0 0 0
4 8 2 0 0 0 0
3 9 1 0 0 0 0
2 10 1 0 0 0 0
5 11 1 0 0 0 0
6 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 2 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
17 18 2 0 0 0 0
18 19 1 0 0 0 0
14 20 1 0 0 0 0
18 21 1 0 0 0 0
10 22 1 0 0 0 0
9 23 1 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 30 2 0 0 0 0
30 31 1 0 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
33 34 2 0 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 0 0 0 0
37 38 2 0 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
40 41 1 0 0 0 0
41 42 2 0 0 0 0
42 43 1 0 0 0 0
43 44 1 0 0 0 0
44 45 1 0 0 0 0
45 46 2 0 0 0 0
46 47 1 0 0 0 0
47 48 1 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
50 51 1 0 0 0 0
51 52 1 0 0 0 0
52 53 1 0 0 0 0
53 54 2 0 0 0 0
54 55 1 0 0 0 0
26 56 1 0 0 0 0
30 57 1 0 0 0 0
34 58 1 0 0 0 0
38 59 1 0 0 0 0
42 60 1 0 0 0 0
46 61 1 0 0 0 0
50 62 1 0 0 0 0
54 63 1 0 0 0 0
19 24 1 0 0 0 0
S SKP 5
ID LBPR02010001
FORMULA C59H90O4
EXACTMASS 862.683911368
AVERAGEMASS 863.3435000000001
SMILES CC(CCC=C(CCC=C(C)C)C)=CCCC(C)=CCCC(=CCCC(=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc(c1=O)c(c(c(c1OC)OC)=O)C)C)C
M END
