Mol:BMCCCC--h027
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 34 0 0 0 0 0 0 0 0999 V2000 | + | 29 34 0 0 0 0 0 0 0 0999 V2000 |
| − | 8.7350 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.7350 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.6010 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.6010 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.6010 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.6010 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.7350 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.7350 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0029 2.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 | + | 7.0029 2.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 6.1369 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.1369 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4049 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4049 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5388 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5388 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5388 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5388 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4049 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4049 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.1369 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.1369 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0029 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0029 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.8690 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.8690 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0029 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0029 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2709 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2709 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2709 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2709 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.1369 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.1369 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.8690 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.8690 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 11.1399 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.1399 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.8690 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.8690 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5388 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5388 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.1369 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.1369 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.5521 -0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.5521 -0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10.5521 0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.5521 0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5878 2.3090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5878 2.3090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5878 0.6910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5878 0.6910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4049 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4049 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0029 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0029 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6 5 2 0 0 0 0 | + | 6 5 2 0 0 0 0 |
| − | 18 13 1 0 0 0 0 | + | 18 13 1 0 0 0 0 |
| − | 13 4 1 0 0 0 0 | + | 13 4 1 0 0 0 0 |
| − | 4 3 2 0 0 0 0 | + | 4 3 2 0 0 0 0 |
| − | 2 1 2 0 0 0 0 | + | 2 1 2 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 5 14 1 0 0 0 0 | + | 5 14 1 0 0 0 0 |
| − | 17 16 1 0 0 0 0 | + | 17 16 1 0 0 0 0 |
| − | 10 9 1 0 0 0 0 | + | 10 9 1 0 0 0 0 |
| − | 8 7 1 0 0 0 0 | + | 8 7 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 25 1 0 0 0 0 | + | 3 25 1 0 0 0 0 |
| − | 25 19 1 0 0 0 0 | + | 25 19 1 0 0 0 0 |
| − | 19 24 1 0 0 0 0 | + | 19 24 1 0 0 0 0 |
| − | 24 2 1 0 0 0 0 | + | 24 2 1 0 0 0 0 |
| − | 7 15 2 0 0 0 0 | + | 7 15 2 0 0 0 0 |
| − | 17 14 1 0 0 0 0 | + | 17 14 1 0 0 0 0 |
| − | 14 13 2 0 0 0 0 | + | 14 13 2 0 0 0 0 |
| − | 18 12 2 0 0 0 0 | + | 18 12 2 0 0 0 0 |
| − | 12 11 1 0 0 0 0 | + | 12 11 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 27 1 0 0 0 0 | + | 9 27 1 0 0 0 0 |
| − | 27 20 1 0 0 0 0 | + | 27 20 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 26 8 1 0 0 0 0 | + | 26 8 1 0 0 0 0 |
| − | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
| − | 5 21 1 0 0 0 0 | + | 5 21 1 0 0 0 0 |
| − | 10 28 1 0 0 0 0 | + | 10 28 1 0 0 0 0 |
| − | 16 10 2 0 0 0 0 | + | 16 10 2 0 0 0 0 |
| − | 28 22 1 0 0 0 0 | + | 28 22 1 0 0 0 0 |
| − | 16 15 1 0 0 0 0 | + | 16 15 1 0 0 0 0 |
| − | 12 29 1 0 0 0 0 | + | 12 29 1 0 0 0 0 |
| − | 15 6 1 0 0 0 0 | + | 15 6 1 0 0 0 0 |
| − | 29 23 1 0 0 0 0 | + | 29 23 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCCC--h027 | + | ID BMCCCC--h027 |
| − | NAME Macarpine | + | NAME Macarpine |
| − | FORMULA C22H18NO6 | + | FORMULA C22H18NO6 |
| − | EXACTMASS 392.1134 | + | EXACTMASS 392.1134 |
| − | AVERAGEMASS 392.3814 | + | AVERAGEMASS 392.3814 |
| − | SMILES c(c62)c(c(cc2c(OC)cc(c65)c(c(c[n+1]5C)4)c(OC)c(c3c4)OCO3)1)OCO1 | + | SMILES c(c62)c(c(cc2c(OC)cc(c65)c(c(c[n+1]5C)4)c(OC)c(c3c4)OCO3)1)OCO1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06165 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06165 |
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 34 0 0 0 0 0 0 0 0999 V2000
8.7350 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6010 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6010 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7350 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0029 2.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
6.1369 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4049 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5388 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5388 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4049 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1369 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0029 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8690 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0029 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2709 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2709 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1369 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8690 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1399 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8690 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5388 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1369 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5521 -0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.5521 0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5878 2.3090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5878 0.6910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4049 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0029 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 5 2 0 0 0 0
18 13 1 0 0 0 0
13 4 1 0 0 0 0
4 3 2 0 0 0 0
2 1 2 0 0 0 0
1 18 1 0 0 0 0
5 14 1 0 0 0 0
17 16 1 0 0 0 0
10 9 1 0 0 0 0
8 7 1 0 0 0 0
2 3 1 0 0 0 0
3 25 1 0 0 0 0
25 19 1 0 0 0 0
19 24 1 0 0 0 0
24 2 1 0 0 0 0
7 15 2 0 0 0 0
17 14 1 0 0 0 0
14 13 2 0 0 0 0
18 12 2 0 0 0 0
12 11 1 0 0 0 0
8 9 2 0 0 0 0
9 27 1 0 0 0 0
27 20 1 0 0 0 0
20 26 1 0 0 0 0
26 8 1 0 0 0 0
11 17 2 0 0 0 0
5 21 1 0 0 0 0
10 28 1 0 0 0 0
16 10 2 0 0 0 0
28 22 1 0 0 0 0
16 15 1 0 0 0 0
12 29 1 0 0 0 0
15 6 1 0 0 0 0
29 23 1 0 0 0 0
S SKP 7
ID BMCCCC--h027
NAME Macarpine
FORMULA C22H18NO6
EXACTMASS 392.1134
AVERAGEMASS 392.3814
SMILES c(c62)c(c(cc2c(OC)cc(c65)c(c(c[n+1]5C)4)c(OC)c(c3c4)OCO3)1)OCO1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06165
M END
