Mol:FL3FRNNP0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 33 37 0 0 0 0 0 0 0 0999 V2000 | + | 33 37 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1179 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1179 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1179 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1179 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8323 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8323 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8323 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8323 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4034 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4034 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3111 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3111 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3111 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3111 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4034 0.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4034 0.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4034 -1.9483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4034 -1.9483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5468 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5468 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5468 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5468 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8323 -1.9483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8323 -1.9483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0256 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0256 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7400 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7400 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7400 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7400 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0256 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0256 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4545 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4545 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4545 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4545 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7400 1.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7400 1.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0256 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0256 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0246 0.1976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0246 0.1976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1690 1.7642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1690 1.7642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3111 1.7642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3111 1.7642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8154 1.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8154 1.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8323 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8323 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5468 1.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5468 1.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2613 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2613 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2613 0.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2613 0.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4211 1.9483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4211 1.9483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8154 1.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8154 1.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4609 -1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4609 -1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4609 -1.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4609 -1.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0365 -0.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0365 -0.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 11 2 0 0 0 0 | + | 3 11 2 0 0 0 0 |
| − | 10 4 2 0 0 0 0 | + | 10 4 2 0 0 0 0 |
| − | 4 1 1 0 0 0 0 | + | 4 1 1 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 2 1 0 0 0 0 | + | 8 2 1 0 0 0 0 |
| − | 5 9 2 0 0 0 0 | + | 5 9 2 0 0 0 0 |
| − | 11 10 1 0 0 0 0 | + | 11 10 1 0 0 0 0 |
| − | 4 12 1 0 0 0 0 | + | 4 12 1 0 0 0 0 |
| − | 6 13 2 0 0 0 0 | + | 6 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 7 2 0 0 0 0 | + | 16 7 2 0 0 0 0 |
| − | 15 17 1 0 0 0 0 | + | 15 17 1 0 0 0 0 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 16 1 0 0 0 0 | + | 20 16 1 0 0 0 0 |
| − | 20 23 2 0 0 0 0 | + | 20 23 2 0 0 0 0 |
| − | 18 22 1 0 0 0 0 | + | 18 22 1 0 0 0 0 |
| − | 17 21 2 0 0 0 0 | + | 17 21 2 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 3 25 1 0 0 0 0 | + | 3 25 1 0 0 0 0 |
| − | 25 26 2 0 0 0 0 | + | 25 26 2 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 11 1 0 0 0 0 | + | 28 11 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | 27 30 1 0 0 0 0 | + | 27 30 1 0 0 0 0 |
| − | 14 31 1 0 0 0 0 | + | 14 31 1 0 0 0 0 |
| − | 31 32 2 0 0 0 0 | + | 31 32 2 0 0 0 0 |
| − | 31 33 1 0 0 0 0 | + | 31 33 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FRNNP0003 | + | ID FL3FRNNP0003 |
| − | KNApSAcK_ID C00013483 | + | KNApSAcK_ID C00013483 |
| − | NAME Artomunoxanthentrione;6-Hydroxy-11-methoxy-3,3-dimethyl-9-(1-methylethenyl)-3H,7H-benzo[c]pyrano[3,2-h]xanthene-7,10,13-trione | + | NAME Artomunoxanthentrione;6-Hydroxy-11-methoxy-3,3-dimethyl-9-(1-methylethenyl)-3H,7H-benzo[c]pyrano[3,2-h]xanthene-7,10,13-trione |
| − | CAS_RN 139921-73-6 | + | CAS_RN 139921-73-6 |
| − | FORMULA C26H20O7 | + | FORMULA C26H20O7 |
| − | EXACTMASS 444.120902994 | + | EXACTMASS 444.120902994 |
| − | AVERAGEMASS 444.43279999999993 | + | AVERAGEMASS 444.43279999999993 |
| − | SMILES O(c31)c(c45)c(c(O)cc(OC(C=C5)(C)C)4)C(=O)c1cc(C(C)=C)c(c32)c(=O)c(OC)cc2=O | + | SMILES O(c31)c(c45)c(c(O)cc(OC(C=C5)(C)C)4)C(=O)c1cc(C(C)=C)c(c32)c(=O)c(OC)cc2=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
33 37 0 0 0 0 0 0 0 0999 V2000
-1.1179 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1179 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8323 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8323 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4034 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3111 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3111 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4034 0.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4034 -1.9483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5468 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5468 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8323 -1.9483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0256 -1.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7400 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7400 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0256 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4545 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4545 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7400 1.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0256 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0246 0.1976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1690 1.7642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3111 1.7642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8154 1.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8323 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5468 1.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2613 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2613 0.5267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4211 1.9483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8154 1.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4609 -1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4609 -1.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0365 -0.7946 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 11 2 0 0 0 0
10 4 2 0 0 0 0
4 1 1 0 0 0 0
1 5 1 0 0 0 0
5 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 2 1 0 0 0 0
5 9 2 0 0 0 0
11 10 1 0 0 0 0
4 12 1 0 0 0 0
6 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 7 2 0 0 0 0
15 17 1 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
20 16 1 0 0 0 0
20 23 2 0 0 0 0
18 22 1 0 0 0 0
17 21 2 0 0 0 0
22 24 1 0 0 0 0
3 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 11 1 0 0 0 0
27 29 1 0 0 0 0
27 30 1 0 0 0 0
14 31 1 0 0 0 0
31 32 2 0 0 0 0
31 33 1 0 0 0 0
S SKP 8
ID FL3FRNNP0003
KNApSAcK_ID C00013483
NAME Artomunoxanthentrione;6-Hydroxy-11-methoxy-3,3-dimethyl-9-(1-methylethenyl)-3H,7H-benzo[c]pyrano[3,2-h]xanthene-7,10,13-trione
CAS_RN 139921-73-6
FORMULA C26H20O7
EXACTMASS 444.120902994
AVERAGEMASS 444.43279999999993
SMILES O(c31)c(c45)c(c(O)cc(OC(C=C5)(C)C)4)C(=O)c1cc(C(C)=C)c(c32)c(=O)c(OC)cc2=O
M END
