Mol:BMMCQN--s008
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 23 24 0 0 0 0 0 0 0 0999 V2000 | + | 23 24 0 0 0 0 0 0 0 0999 V2000 |
− | 4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.3301 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.3301 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.1962 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
− | 10 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
− | 4 3 1 0 0 0 0 | + | 4 3 1 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 |
− | 9 1 1 0 0 0 0 | + | 9 1 1 0 0 0 0 |
− | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
− | 8 7 2 0 0 0 0 | + | 8 7 2 0 0 0 0 |
− | 7 6 1 0 0 0 0 | + | 7 6 1 0 0 0 0 |
− | 6 5 2 0 0 0 0 | + | 6 5 2 0 0 0 0 |
− | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
− | 1 22 2 0 0 0 0 | + | 1 22 2 0 0 0 0 |
− | 4 23 2 0 0 0 0 | + | 4 23 2 0 0 0 0 |
− | 2 21 1 0 0 0 0 | + | 2 21 1 0 0 0 0 |
− | 3 11 1 0 0 0 0 | + | 3 11 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
− | 17 20 1 0 0 0 0 | + | 17 20 1 0 0 0 0 |
− | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
− | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMMCQN--s008 | + | ID BMMCQN--s008 |
− | NAME Menaquinone | + | NAME Menaquinone |
− | FORMULA C21H24O2 | + | FORMULA C21H24O2 |
− | EXACTMASS 308.1776 | + | EXACTMASS 308.1776 |
− | AVERAGEMASS 308.414 | + | AVERAGEMASS 308.414 |
− | SMILES CC(CCC=C(C)C)=CCc(c2C)c(c(c1)c(c2=O)ccc1)=O | + | SMILES CC(CCC=C(C)C)=CCc(c2C)c(c(c1)c(c2=O)ccc1)=O |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00828 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00828 |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 23 24 0 0 0 0 0 0 0 0999 V2000 4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 4 3 1 0 0 0 0 3 2 2 0 0 0 0 2 1 1 0 0 0 0 9 1 1 0 0 0 0 9 8 1 0 0 0 0 8 7 2 0 0 0 0 7 6 1 0 0 0 0 6 5 2 0 0 0 0 10 5 1 0 0 0 0 1 22 2 0 0 0 0 4 23 2 0 0 0 0 2 21 1 0 0 0 0 3 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 20 1 0 0 0 0 17 18 1 0 0 0 0 13 19 1 0 0 0 0 S SKP 7 ID BMMCQN--s008 NAME Menaquinone FORMULA C21H24O2 EXACTMASS 308.1776 AVERAGEMASS 308.414 SMILES CC(CCC=C(C)C)=CCc(c2C)c(c(c1)c(c2=O)ccc1)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00828 M END