Mol:BMCCID--k023
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 13 14 0 0 0 0 0 0 0 0999 V2000 | + | 13 14 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.9563 1.7685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9563 1.7685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3685 0.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3685 0.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9563 0.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9563 0.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7734 -0.0405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7734 -0.0405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.6394 0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.6394 0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.6394 1.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.6394 1.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7734 1.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7734 1.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9074 1.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9074 1.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9074 0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9074 0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6473 -0.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6473 -0.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6691 -1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6691 -1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3601 -1.9595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3601 -1.9595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
| − | 5 4 2 0 0 0 0 | + | 5 4 2 0 0 0 0 |
| − | 4 9 1 0 0 0 0 | + | 4 9 1 0 0 0 0 |
| − | 8 7 1 0 0 0 0 | + | 8 7 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 8 1 0 0 0 0 | + | 1 8 1 0 0 0 0 |
| − | 9 3 1 0 0 0 0 | + | 9 3 1 0 0 0 0 |
| − | 3 10 1 0 0 0 0 | + | 3 10 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 13 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCID--k023 | + | ID BMCCID--k023 |
| − | NAME Indole-3-acetic acid | + | NAME Indole-3-acetic acid |
| − | FORMULA C10H9NO2 | + | FORMULA C10H9NO2 |
| − | EXACTMASS 175.0633 | + | EXACTMASS 175.0633 |
| − | AVERAGEMASS 175.184 | + | AVERAGEMASS 175.184 |
| − | SMILES OC(=O)Cc(c1)c(c2)c(ccc2)n1 | + | SMILES OC(=O)Cc(c1)c(c2)c(ccc2)n1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00954 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00954 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
13 14 0 0 0 0 0 0 0 0999 V2000
3.9563 1.7685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3685 0.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9563 0.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7734 -0.0405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6394 0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6394 1.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7734 1.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9074 1.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9074 0.4595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6473 -0.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6691 -1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3601 -1.9595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 7 2 0 0 0 0
6 5 1 0 0 0 0
5 4 2 0 0 0 0
4 9 1 0 0 0 0
8 7 1 0 0 0 0
8 9 2 0 0 0 0
3 2 2 0 0 0 0
2 1 1 0 0 0 0
1 8 1 0 0 0 0
9 3 1 0 0 0 0
3 10 1 0 0 0 0
11 12 1 0 0 0 0
11 13 2 0 0 0 0
10 11 1 0 0 0 0
S SKP 7
ID BMCCID--k023
NAME Indole-3-acetic acid
FORMULA C10H9NO2
EXACTMASS 175.0633
AVERAGEMASS 175.184
SMILES OC(=O)Cc(c1)c(c2)c(ccc2)n1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00954
M END
