Mol:FL3FALNI0016
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
36 38 0 0 0 0 0 0 0 0999 V2000
0.0000 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4289 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4289 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7145 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4289 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4289 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7145 0.6191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8579 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5724 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5724 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8579 1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7145 -1.8559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2868 1.8566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1434 0.6191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 -1.8559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8579 -0.6184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1434 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5724 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2868 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5724 -1.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 1.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4278 1.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4278 2.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1410 3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 -1.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8567 -2.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8567 -3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5700 -1.8545 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
1 7 1 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 2 1 0 0 0 0
9 11 1 0 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
18 14 1 0 0 0 0
4 19 1 0 0 0 0
6 20 1 0 0 0 0
12 21 1 0 0 0 0
5 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
3 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
8 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
34 36 1 0 0 0 0
S SKP 8
ID FL3FALNI0016
KNApSAcK_ID C00013415
NAME Artelasticin;2-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-3,6,8-tris(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 182052-13-7
FORMULA C30H34O6
EXACTMASS 490.23553882
AVERAGEMASS 490.58736000000005
SMILES C(C)(C)=CCc(c31)c(O)c(CC=C(C)C)c(O)c(C(=O)C(CC=C(C)C)=C(O3)c(c2)c(O)cc(c2)O)1
M END
