KEGG   COMPOUND: C06772Help
Entry
C06772                      Compound                               

Name
Diethanolamine
Formula
C4H11NO2
Exact mass
105.079
Mol weight
105.1356
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Glycerophospholipid metabolism
Enzyme
4.3.3.-
Brite
Carcinogens [BR:br08008]
 Group 2B: Possibly carcinogenic to humans
  Compounds
   C06772  Diethanolamine
Pharmaceutical additives [BR:br08316]
 Stabilizing agent
  D02337  [101808] Diethanolamine
 Buffering agent
  D02337  [101808] Diethanolamine
 Solubilization agent
  D02337  [101808] Diethanolamine
BRITE hierarchy
Other DBs
CAS: 
111-42-2
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        7
            1   N1b N    21.7700  -16.6825
            2   C1b C    20.5542  -17.3782
            3   C1b C    22.9858  -17.3782
            4   C1b C    19.3382  -16.6825
            5   C1b C    24.2018  -16.6825
            6   O1a O    18.1224  -17.3782
            7   O1a O    25.4118  -17.3782
BOND        6
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1

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