Mol:BMMCBZ3Sq003
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 11 11 0 0 1 0 0 0 0 0 1 V2000 | + | 11 11 0 0 1 0 0 0 0 0 1 V2000 |
− | 21.6005 -4.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 21.6005 -4.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 21.6005 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 21.6005 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 20.4487 -6.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 20.4487 -6.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 19.2969 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 19.2969 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 19.2969 -4.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 19.2969 -4.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 20.4487 -3.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 20.4487 -3.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 22.7523 -3.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 22.7523 -3.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 18.1450 -6.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 18.1450 -6.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 16.9932 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 16.9932 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 18.1450 -7.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 18.1450 -7.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 20.4487 -7.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 20.4487 -7.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
− | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
− | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
− | 2 1 2 0 0 0 0 | + | 2 1 2 0 0 0 0 |
− | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
− | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
− | 3 11 1 6 0 0 0 | + | 3 11 1 6 0 0 0 |
− | 4 8 1 1 0 0 0 | + | 4 8 1 1 0 0 0 |
− | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
− | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMMCBZ3Sq003 | + | ID BMMCBZ3Sq003 |
− | NAME (-)-trans-Isopiperitenol | + | NAME (-)-trans-Isopiperitenol |
− | FORMULA C10H16O | + | FORMULA C10H16O |
− | EXACTMASS 152.1201 | + | EXACTMASS 152.1201 |
− | AVERAGEMASS 152.2334 | + | AVERAGEMASS 152.2334 |
− | SMILES CC(C1)=CC(O)C(C1)C(C)=C | + | SMILES CC(C1)=CC(O)C(C1)C(C)=C |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01123 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01123 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 11 11 0 0 1 0 0 0 0 0 1 V2000 21.6005 -4.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6005 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4487 -6.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2969 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2969 -4.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4487 -3.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7523 -3.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1450 -6.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9932 -5.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1450 -7.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4487 -7.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6 5 1 0 0 0 0 4 5 1 0 0 0 0 4 3 1 0 0 0 0 3 2 1 0 0 0 0 2 1 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 3 11 1 6 0 0 0 4 8 1 1 0 0 0 8 10 1 0 0 0 0 8 9 2 0 0 0 0 S SKP 7 ID BMMCBZ3Sq003 NAME (-)-trans-Isopiperitenol FORMULA C10H16O EXACTMASS 152.1201 AVERAGEMASS 152.2334 SMILES CC(C1)=CC(O)C(C1)C(C)=C KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01123 M END