Mol:FL2FA9NP0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.8466 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8466 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8466 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8466 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2903 -1.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2903 -1.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2660 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2660 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2660 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2660 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2903 0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2903 0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8223 -1.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8223 -1.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3786 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3786 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3786 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3786 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8223 0.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8223 0.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9347 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9347 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5017 -0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5017 -0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0686 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0686 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0686 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0686 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5017 1.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5017 1.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9347 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9347 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8223 -1.5610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8223 -1.5610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2903 -1.6593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2903 -1.6593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2903 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2903 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8466 1.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8466 1.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4029 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4029 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4029 0.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4029 0.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4027 -1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4027 -1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9588 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9588 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5137 -1.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5137 -1.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0686 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0686 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5137 -1.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5137 -1.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9590 1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9590 1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4029 1.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4029 1.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 1 1 0 0 0 0 | + | 22 1 1 0 0 0 0 |
| − | 2 23 1 0 0 0 0 | + | 2 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | 21 28 1 0 0 0 0 | + | 21 28 1 0 0 0 0 |
| − | 21 29 1 0 0 0 0 | + | 21 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA9NP0002 | + | ID FL2FA9NP0002 |
| − | KNApSAcK_ID C00008191 | + | KNApSAcK_ID C00008191 |
| − | NAME Fulvinervin A | + | NAME Fulvinervin A |
| − | CAS_RN 99877-71-1 | + | CAS_RN 99877-71-1 |
| − | FORMULA C25H26O4 | + | FORMULA C25H26O4 |
| − | EXACTMASS 390.18310931999997 | + | EXACTMASS 390.18310931999997 |
| − | AVERAGEMASS 390.47153999999995 | + | AVERAGEMASS 390.47153999999995 |
| − | SMILES c(CC=C(C)C)(c(O)2)c(O1)c(c(O3)c(C(CC3c(c4)cccc4)=O)2)C=CC1(C)C | + | SMILES c(CC=C(C)C)(c(O)2)c(O1)c(c(O3)c(C(CC3c(c4)cccc4)=O)2)C=CC1(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-0.8466 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8466 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2903 -1.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2660 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2660 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2903 0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8223 -1.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3786 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3786 -0.0537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8223 0.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9347 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5017 -0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0686 0.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0686 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5017 1.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9347 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8223 -1.5610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2903 -1.6593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2903 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8466 1.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4029 0.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4029 0.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4027 -1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9588 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5137 -1.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0686 -0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5137 -1.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9590 1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4029 1.6593 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 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 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 5 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
3 18 1 0 0 0 0
6 19 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 1 1 0 0 0 0
2 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
21 28 1 0 0 0 0
21 29 1 0 0 0 0
S SKP 8
ID FL2FA9NP0002
KNApSAcK_ID C00008191
NAME Fulvinervin A
CAS_RN 99877-71-1
FORMULA C25H26O4
EXACTMASS 390.18310931999997
AVERAGEMASS 390.47153999999995
SMILES c(CC=C(C)C)(c(O)2)c(O1)c(c(O3)c(C(CC3c(c4)cccc4)=O)2)C=CC1(C)C
M END
