Mol:BMSUD2AiCC01

From Metabolomics.JP
Revision as of 09:00, 2 February 2009 by Editor (Talk | contribs)

(diff) ← Older revision | Latest revision (diff) | Newer revision → (diff)
Jump to: navigation, search

BMSUD2AiCC01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 26 27  0  0  1  0  0  0  0  0999 V2000
    3.7321   -0.7500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8660   -1.2500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8660   -2.2500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7321   -2.7500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.5981   -2.2500    0.0000 C   0  0  1  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    1.7500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3301    0.7500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.4641    0.2500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5981    0.7500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.5981    1.7500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.7321    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -3.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    3.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622    3.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 19  6  1  0  0  0  0
  5 18  1  6  0  0  0
  1 18  1  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1 23  1  1  0  0  0
  3 16  1  6  0  0  0
  4 17  1  1  0  0  0
 25 12  1  0  0  0  0
 11 24  1  1  0  0  0
  7 24  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  7 20  1  0  0  0  0
  8 21  1  6  0  0  0
  9 22  1  1  0  0  0
 10 23  1  6  0  0  0
  2 15  1  1  0  0  0
 20 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 26  2  0  0  0  0
S  SKP  7
ID	BMSUD2AiCC01
NAME	Acetyl-maltose
FORMULA	C14H24O12
EXACTMASS	384.1267
AVERAGEMASS	384.3331
SMILES	OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@H]([C@@H](CO)2)[C@H](O)[C@@H](O)[C@H](OC(C)=O)O2
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02130
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox