Mol:FL3FQUNP0001

From Metabolomics.JP
Jump to: navigation, search

FL3FQUNP0001.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 36 41  0  0  0  0  0  0  0  0999 V2000 
   -1.0717   -0.1814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717    0.6436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862    1.0561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5006    0.6436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5006   -0.1814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862   -0.5939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -0.5939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572   -0.1814    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    0.6436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572    1.0561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717    1.0561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717    1.8811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    2.2936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572    1.8811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862    0.6436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006    1.0561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5006    1.8811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862    2.2936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    3.1186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572    3.5311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717    3.1186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717    2.2936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -1.4189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717   -1.8314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0717   -2.6564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -3.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572   -2.6564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572   -1.8314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8842    2.9754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3539    3.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3131    1.7379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7828    2.6564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3131    0.5004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7828    1.4189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0717   -1.4189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572   -3.8939    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  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  1  0  0  0  0 
  1  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10  2  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 10  1  0  0  0  0 
 11 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  1  0  0  0  0 
 18 12  1  0  0  0  0 
 13 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 14  1  0  0  0  0 
  7 23  2  0  0  0  0 
 23 24  1  0  0  0  0 
 24 25  2  0  0  0  0 
 25 26  1  0  0  0  0 
 26 27  2  0  0  0  0 
 27 28  1  0  0  0  0 
 28 23  1  0  0  0  0 
 21 29  1  0  0  0  0 
 21 30  1  0  0  0  0 
 17 31  1  0  0  0  0 
 17 32  1  0  0  0  0 
  4 33  1  0  0  0  0 
  4 34  1  0  0  0  0 
 28 35  2  0  0  0  0 
 26 36  1  0  0  0  0 
S  SKP  8 
ID	FL3FQUNP0001 
KNApSAcK_ID	C00013430 
NAME	Dorsilurin E;2,(6Z)-6-(3,4,7,8,12,13-Hexahydro-2,2,6,6,13,13-hexamethyl-2H,6H,10H,11H-tripyrano[3,2-c:2',3'-f:2'',3''-h][1]benzopyran-10-ylidene)-3-hydroxy-4-cyclohexadien-1-one 
CAS_RN	254101-17-2 
FORMULA	C30H34O6 
EXACTMASS	490.23553882 
AVERAGEMASS	490.58736000000005 
SMILES	c(c54)(O6)c(CCC6(C)C)c(c2c4OC(CC5)(C)C)OC(=c(c3)c(=O)cc(O)c3)C(=C21)CCC(C)(C)O1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox