Mol:FL4DALNI0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
42 44 0 0 0 0 0 0 0 0999 V2000
-5.0276 -0.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3075 -0.4436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0363 -1.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3235 -2.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6079 -1.6908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5967 -0.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8948 -2.1131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1768 -1.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1700 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8766 -0.4632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4481 -0.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4392 0.3434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7201 0.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0118 0.3299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0181 -0.4931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7381 -0.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9098 -2.9380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3384 -2.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7344 -0.4245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4699 -2.1318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7100 0.7294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7381 -1.6559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7279 -0.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4374 -0.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1518 -0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1518 -1.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8906 -0.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5502 -0.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3272 -0.4323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0545 -0.8522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0545 -1.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7344 -0.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7201 1.5303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4051 1.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4051 2.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8261 2.9380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9480 2.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3075 0.3078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9875 0.7004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9875 1.3638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2900 1.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6448 1.7433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 2 1 0 0 0 0
5 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 6 1 0 0 0 0
9 11 1 6 0 0 0
11 12 2 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 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
4 18 1 0 0 0 0
8 20 1 1 0 0 0
1 19 1 0 0 0 0
14 21 1 0 0 0 0
16 22 1 0 0 0 0
15 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
25 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
30 32 1 0 0 0 0
13 33 1 0 0 0 0
33 34 1 0 0 0 0
34 35 2 0 0 0 0
35 36 1 0 0 0 0
35 37 1 0 0 0 0
2 38 1 0 0 0 0
38 39 1 0 0 0 0
39 40 2 0 0 0 0
40 41 1 0 0 0 0
40 42 1 0 0 0 0
S SKP 8
ID FL4DALNI0011
KNApSAcK_ID C00014388
NAME Sanggenol E;3,5,7,2',4'-Pentahydroxy-8,5'-diprenyl-3'-geranylflavanone
CAS_RN 174423-34-8
FORMULA C35H44O7
EXACTMASS 576.3087037619999
AVERAGEMASS 576.71966
SMILES C(C=C(CCC=C(C)C)C)c(c1O)c(c(cc1C(O3)C(O)C(c(c23)c(O)cc(c(CC=C(C)C)2)O)=O)CC=C(C)C)O
M END
