Mol:FL2FALNP0015
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
36 40 0 0 0 0 0 0 0 0999 V2000
-1.6378 -0.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1170 -0.9693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5961 -0.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5961 -0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1170 0.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6378 -0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0752 -0.9693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4457 -0.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4457 -0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0752 0.2336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9661 0.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0752 -1.4933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5004 -0.0752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0348 0.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0348 0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5004 1.1588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9661 0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1587 0.2336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1170 -1.5702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5691 1.1588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1170 0.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6373 1.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1582 -0.9691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6786 -0.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5691 -0.0752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1035 0.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1035 0.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4616 1.4705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7170 0.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4326 1.1583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1587 0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1978 -0.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7170 -0.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1978 -1.5679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3557 1.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7986 0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 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 1 1 0 0 0 0
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 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 11 1 0 0 0 0
6 18 1 0 0 0 0
2 19 1 0 0 0 0
20 15 1 0 0 0 0
5 21 1 0 0 0 0
21 22 2 0 0 0 0
1 23 1 0 0 0 0
23 24 1 0 0 0 0
14 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
27 20 1 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
17 30 1 0 0 0 0
22 31 1 0 0 0 0
31 18 1 0 0 0 0
24 32 2 0 0 0 0
32 33 1 0 0 0 0
32 34 1 0 0 0 0
31 35 1 0 0 0 0
31 36 1 0 0 0 0
S SKP 8
ID FL2FALNP0015
KNApSAcK_ID C00008472
NAME Euchrenone a12
CAS_RN 137319-41-6
FORMULA C30H32O6
EXACTMASS 488.219888756
AVERAGEMASS 488.57148
SMILES c(c5O)(c(O1)c(c(c54)OC(CC4=O)c(c(O)2)cc(C=3)c(OC(C)(C)C3)c2)C=CC1(C)C)CC=C(C)C
M END
