Mol:BMFYS6DAp002
From Metabolomics.JP
(Difference between revisions)
| Line 28: | Line 28: | ||
S SKP 7 | S SKP 7 | ||
ID BMFYS6DAp002 | ID BMFYS6DAp002 | ||
| − | NAME 2-Hydroxy-3- | + | NAME 2-Hydroxy-3-oxohexanedioic acid |
| + | CAS_RN 26015-36-1 | ||
FORMULA C6H8O6 | FORMULA C6H8O6 | ||
EXACTMASS 176.032 | EXACTMASS 176.032 | ||
Latest revision as of 12:00, 17 June 2010
Copyright: ARM project http://www.metabolome.jp/
12 11 0 0 1 0 0 0 0 0999 V2000
2.8660 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 4 1 0 0 0 0
3 2 1 0 0 0 0
1 7 1 0 0 0 0
1 8 2 0 0 0 0
2 1 1 0 0 0 0
3 9 2 0 0 0 0
4 5 1 0 0 0 0
6 10 1 0 0 0 0
6 11 2 0 0 0 0
5 6 1 0 0 0 0
2 12 1 4 0 0 0
S SKP 7
ID BMFYS6DAp002
NAME 2-Hydroxy-3-oxohexanedioic acid
CAS_RN 26015-36-1
FORMULA C6H8O6
EXACTMASS 176.032
AVERAGEMASS 176.1241
SMILES OC(=O)CCC(=O)C(O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03217
M END
