Mol:KOX00637
From Metabolomics.JP
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− | 10 11 0 1 0 999 V2000 | + | 10 11 0 1 0 999 V2000 |
− | -0.6348 1.2375 0.0000 C 0 0 | + | -0.6348 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | -1.3492 0.8250 0.0000 C 0 0 | + | -1.3492 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | -1.3492 0.0000 0.0000 C 0 0 | + | -1.3492 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | -0.6348 -0.4125 0.0000 C 0 0 | + | -0.6348 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | 0.0797 0.0000 0.0000 C 0 0 | + | 0.0797 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | 0.0797 0.8250 0.0000 C 0 0 | + | 0.0797 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | 0.8643 -0.2549 0.0000 C 0 0 | + | 0.8643 -0.2549 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | 1.3492 0.4125 0.0000 C 0 0 | + | 1.3492 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 |
− | 0.8643 1.0799 0.0000 N 0 0 | + | 0.8643 1.0799 0.0000 N 0 0 0 0 0 0 0 0 0 |
− | -0.6348 -1.2375 0.0000 N 0 0 | + | -0.6348 -1.2375 0.0000 N 0 0 0 0 0 0 0 0 0 |
− | 1 2 2 0 0 0 | + | 1 2 2 0 0 0 |
− | 2 3 1 0 0 0 | + | 2 3 1 0 0 0 |
− | 3 4 2 0 0 0 | + | 3 4 2 0 0 0 |
− | 4 5 1 0 0 0 | + | 4 5 1 0 0 0 |
− | 5 6 2 0 0 0 | + | 5 6 2 0 0 0 |
− | 6 1 1 0 0 0 | + | 6 1 1 0 0 0 |
− | 5 7 1 0 0 0 | + | 5 7 1 0 0 0 |
− | 7 8 2 0 0 0 | + | 7 8 2 0 0 0 |
− | 8 9 1 0 0 0 | + | 8 9 1 0 0 0 |
− | 9 6 1 0 0 0 | + | 9 6 1 0 0 0 |
− | 4 10 1 0 0 0 | + | 4 10 1 0 0 0 |
+ | S SKP 8 | ||
+ | CAS_RN 5192-23-4 | ||
+ | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+null | ||
+ | NAME 4-Aminoindole | ||
+ | ID KOX00637 | ||
+ | FORMULA C8H8N2 | ||
+ | EXACTMASS 132.068748266 | ||
+ | AVERAGEMASS 132.1626 | ||
+ | SMILES Nc(c2)c(c1)c(cc2)nc1 | ||
M END | M END |
Latest revision as of 16:38, 11 June 2009
10 11 0 1 0 999 V2000 -0.6348 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3492 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3492 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6348 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0.0797 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0.0797 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0.8643 -0.2549 0.0000 C 0 0 0 0 0 0 0 0 0 1.3492 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0.8643 1.0799 0.0000 N 0 0 0 0 0 0 0 0 0 -0.6348 -1.2375 0.0000 N 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 5 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 6 1 0 0 0 4 10 1 0 0 0 S SKP 8 CAS_RN 5192-23-4 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+null NAME 4-Aminoindole ID KOX00637 FORMULA C8H8N2 EXACTMASS 132.068748266 AVERAGEMASS 132.1626 SMILES Nc(c2)c(c1)c(cc2)nc1 M END