Mol:FL3FQUNR0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 37 40 0 0 0 0 0 0 0 0999 V2000 | + | 37 40 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.3298 -1.3599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3298 -1.3599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3251 -0.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3251 -0.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3823 -1.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3823 -1.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0991 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0991 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1038 -0.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1038 -0.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3917 -0.1265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3917 -0.1265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3776 -2.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3776 -2.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8112 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8112 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5280 -1.3761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5280 -1.3761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5327 -0.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5327 -0.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8206 -0.1346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8206 -0.1346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0372 -0.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0372 -0.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7540 -0.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7540 -0.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7587 -1.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7587 -1.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0466 -1.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0466 -1.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2418 -0.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2418 -0.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2387 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2387 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5266 1.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5266 1.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8176 0.7034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8176 0.7034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2369 1.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2369 1.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8318 -0.4704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8318 -0.4704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8628 1.0686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8628 1.0686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5266 2.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5266 2.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2603 2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2603 2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9091 2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9091 2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9091 1.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9091 1.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4418 2.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4418 2.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2253 -1.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2253 -1.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2253 -2.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2253 -2.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8665 -1.4085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8665 -1.4085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3905 -0.1594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3905 -0.1594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0466 -2.4810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0466 -2.4810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4201 -1.7337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4201 -1.7337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1098 -1.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1098 -1.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8322 -1.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8322 -1.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8322 -2.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8322 -2.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4418 -1.4006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4418 -1.4006 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 |
| − | 1 3 1 0 0 0 0 | + | 1 3 1 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 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
| − | 3 7 2 0 0 0 0 | + | 3 7 2 0 0 0 0 |
| − | 4 8 1 0 0 0 0 | + | 4 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 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 5 1 0 0 0 0 | + | 11 5 1 0 0 0 0 |
| − | 2 12 2 0 0 0 0 | + | 2 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 1 2 0 0 0 0 | + | 15 1 2 0 0 0 0 |
| − | 10 16 1 0 0 0 0 | + | 10 16 1 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 18 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 11 1 0 0 0 0 | + | 19 11 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 16 21 2 0 0 0 0 | + | 16 21 2 0 0 0 0 |
| − | 17 22 1 0 0 0 0 | + | 17 22 1 0 0 0 0 |
| − | 18 23 1 0 0 0 0 | + | 18 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 |
| − | 9 28 1 0 0 0 0 | + | 9 28 1 0 0 0 0 |
| − | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 13 31 1 0 0 0 0 | + | 13 31 1 0 0 0 0 |
| − | 15 32 1 0 0 0 0 | + | 15 32 1 0 0 0 0 |
| − | 14 33 1 0 0 0 0 | + | 14 33 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 34 35 2 0 0 0 0 | + | 34 35 2 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 35 37 1 0 0 0 0 | + | 35 37 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FQUNR0001 | + | ID FL3FQUNR0001 |
| − | KNApSAcK_ID C00013493 | + | KNApSAcK_ID C00013493 |
| − | NAME Artonin O;5,6-Dihydro-3,8,10-trihydroxy-2,9-bis(3-methyl-2-butenyl)-5-(1-methylethenyl)-1H-benzo[c]xanthene-1,4,7-trione | + | NAME Artonin O;5,6-Dihydro-3,8,10-trihydroxy-2,9-bis(3-methyl-2-butenyl)-5-(1-methylethenyl)-1H-benzo[c]xanthene-1,4,7-trione |
| − | CAS_RN 151652-48-1 | + | CAS_RN 151652-48-1 |
| − | FORMULA C30H30O7 | + | FORMULA C30H30O7 |
| − | EXACTMASS 502.199153314 | + | EXACTMASS 502.199153314 |
| − | AVERAGEMASS 502.55500000000006 | + | AVERAGEMASS 502.55500000000006 |
| − | SMILES c(C(=O)2)(c1O)c(OC(c43)=C2CC(C(C)=C)c3c(c(c(CC=C(C)C)c(=O)4)O)=O)cc(c(CC=C(C)C)1)O | + | SMILES c(C(=O)2)(c1O)c(OC(c43)=C2CC(C(C)=C)c3c(c(c(CC=C(C)C)c(=O)4)O)=O)cc(c(CC=C(C)C)1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
37 40 0 0 0 0 0 0 0 0999 V2000
-0.3298 -1.3599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3251 -0.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3823 -1.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0991 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1038 -0.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3917 -0.1265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3776 -2.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8112 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5280 -1.3761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5327 -0.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8206 -0.1346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0372 -0.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7540 -0.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7587 -1.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0466 -1.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2418 -0.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2387 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5266 1.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8176 0.7034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2369 1.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8318 -0.4704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8628 1.0686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5266 2.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2603 2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9091 2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9091 1.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4418 2.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2253 -1.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2253 -2.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8665 -1.4085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3905 -0.1594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0466 -2.4810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4201 -1.7337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1098 -1.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8322 -1.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8322 -2.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4418 -1.4006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 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 2 1 0 0 0 0
3 7 2 0 0 0 0
4 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 5 1 0 0 0 0
2 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 1 2 0 0 0 0
10 16 1 0 0 0 0
16 17 1 0 0 0 0
17 18 2 0 0 0 0
18 19 1 0 0 0 0
19 11 1 0 0 0 0
19 20 2 0 0 0 0
16 21 2 0 0 0 0
17 22 1 0 0 0 0
18 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
9 28 1 0 0 0 0
28 29 2 0 0 0 0
28 30 1 0 0 0 0
13 31 1 0 0 0 0
15 32 1 0 0 0 0
14 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
S SKP 8
ID FL3FQUNR0001
KNApSAcK_ID C00013493
NAME Artonin O;5,6-Dihydro-3,8,10-trihydroxy-2,9-bis(3-methyl-2-butenyl)-5-(1-methylethenyl)-1H-benzo[c]xanthene-1,4,7-trione
CAS_RN 151652-48-1
FORMULA C30H30O7
EXACTMASS 502.199153314
AVERAGEMASS 502.55500000000006
SMILES c(C(=O)2)(c1O)c(OC(c43)=C2CC(C(C)=C)c3c(c(c(CC=C(C)C)c(=O)4)O)=O)cc(c(CC=C(C)C)1)O
M END
