Mol:LBPR01070184
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
54 55 0 0 0 0 0 0 0 0999 V2000
3.8660 -8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 -7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 -7.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3301 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3301 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1962 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0622 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0622 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9282 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9282 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7942 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7942 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6603 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6603 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9282 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6603 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -9.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 -10.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.7321 -10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 -9.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.5263 6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.5263 7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 -8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 -8.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -9.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.3923 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.3923 8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.3923 9.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
14.2583 9.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7583 10.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.1244 10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6603 9.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
9.9282 9.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
11.6603 10.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.0622 8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9282 10.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
10.7942 10.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
14.7583 8.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.5263 9.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 -11.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.7942 8.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1962 9.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.5263 10.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.7942 11.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0622 10.5000 0.0000 O 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 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 20 1 0 0 0 0
4 21 1 0 0 0 0
8 22 1 0 0 0 0
13 23 1 0 0 0 0
17 24 1 0 0 0 0
25 1 1 0 0 0 0
25 26 1 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 1 2 0 0 0 0
30 20 2 0 0 0 0
30 31 1 0 0 0 0
29 32 1 0 0 0 0
25 33 1 0 0 0 0
25 34 1 0 0 0 0
30 35 1 0 0 0 0
31 36 2 0 0 0 0
37 36 1 0 0 0 0
37 38 1 0 0 0 0
38 47 1 0 0 0 0
38 39 1 0 0 0 0
38 40 1 0 0 0 0
37 48 1 1 0 0 0
27 49 1 1 0 0 0
48 41 1 0 0 0 0
41 50 1 4 0 0 0
42 50 1 6 0 0 0
41 43 1 0 0 0 0
42 44 1 0 0 0 0
44 51 1 0 0 0 0
43 52 1 1 0 0 0
42 45 1 0 0 0 0
45 46 1 0 0 0 0
46 53 1 6 0 0 0
43 46 1 0 0 0 0
45 54 1 1 0 0 0
S SKP 5
ID LBPR01070184
FORMULA C46H66O8
EXACTMASS 746.475769088
AVERAGEMASS 747.01144
SMILES C(C)(=CC=CC(C)=CC=CC=C(C)C=CC=C(C=CC(=C2C)C(C[C@H](O)C2)(C)C)C)C=CC=C(C)C=C[C@@H](OC([C@@H]1O)O[C@H](CO)[C@@H](O)[C@H](O)1)C(O)(C)C
M END
