Mol:FL5FAJGA0002

From Metabolomics.JP
Revision as of 09:00, 7 October 2008 by Editor (Talk | contribs)

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

FL5FAJGA0002.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 35 38  0  0  0  0  0  0  0  0999 V2000
   -1.9855   -0.6241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3194   -0.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3194    0.5296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9855    0.9142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6516    0.5296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6516   -0.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6533   -0.6241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0128   -0.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0128    0.5296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6533    0.9142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7497    0.9551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3974    0.5811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0451    0.9551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0451    1.7030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3974    2.0769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7497    1.7030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3440    0.9294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9855   -1.3008    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6533   -1.2028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3974    2.6924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6182    0.6242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6322    2.0419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6534   -0.6094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3440    2.0419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2990   -2.2568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5984   -2.6924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0068   -2.1317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8133   -1.9578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1127   -1.5221    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4926   -2.0827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8678   -1.6822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3044   -1.6679    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6590   -2.0490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0483   -2.6777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0114   -2.6897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  3  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  5 17  1  0  0  0  0
  1 18  1  0  0  0  0
  7 19  2  0  0  0  0
 15 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
  8 23  1  0  0  0  0
 22 24  1  0  0  0  0
 25 26  1  1  0  0  0
 26 27  1  1  0  0  0
 28 27  1  1  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 25  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 25 33  1  0  0  0  0
 26 34  1  0  0  0  0
 27 35  1  0  0  0  0
 23 28  1  0  0  0  0
S  SKP  8
ID	FL5FAJGA0002
KNApSAcK_ID	C00011180
NAME	Myricetin 4'-methyl ether 3-O-beta-D-galactopyranoside;2-(3,5-Dihydroxy-4-methoxyphenyl)-3-(beta-D-galactopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one
CAS_RN	230283-36-0
FORMULA	C22H22O13
EXACTMASS	494.10604078999995
AVERAGEMASS	494.40228
SMILES	c(C(=O)1)(c4O)c(cc(c4)O)OC(c(c3)cc(c(OC)c(O)3)O)=C1OC(O2)C(O)C(C(C(CO)2)O)O
M  END

</pre>

Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox