Mol:BMCCID--q018

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Line 26: Line 26:
 
S  SKP  7  
 
S  SKP  7  
 
ID BMCCID--q018  
 
ID BMCCID--q018  
NAME Hydroxy-indole
+
NAME 1H-Indol-4-ol
 +
CAS_RN 2380-94-1
 
FORMULA C8H7NO  
 
FORMULA C8H7NO  
 
EXACTMASS 133.0527  
 
EXACTMASS 133.0527  

Latest revision as of 17:51, 11 June 2010

BMCCID--q018.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 10 11  0  0  0  0  0  0  0  0999 V2000 
    3.5241   -1.4368    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5296   -1.5413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1229   -0.6278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    1.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    1.5413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    1.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981    0.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -0.4587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660    0.0413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.5413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  5  4  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  7  2  0  0  0  0 
  7  8  1  0  0  0  0 
  9  4  1  0  0  0  0 
  8  9  2  0  0  0  0 
  3  2  2  0  0  0  0 
  2  1  1  0  0  0  0 
  1  8  1  0  0  0  0 
  9  3  1  0  0  0  0 
  4 10  1  0  0  0  0 
S  SKP  7 
ID	BMCCID--q018 
NAME	1H-Indol-4-ol 
CAS_RN	 2380-94-1 
FORMULA	C8H7NO 
EXACTMASS	133.0527 
AVERAGEMASS	133.1473 
SMILES	Oc(c2)c(c1)c(cc2)nc1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C02040 
M  END
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