KEGG   COMPOUND: C01875Help
Entry
C01875                      Compound                               

Name
2-Undecanone;
Undecan-2-one;
Methyl nonyl ketone;
2-Hendecanone
Formula
C11H22O
Exact mass
170.1671
Mol weight
170.2918
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Enzyme
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA12 Oxygenated hydrocarbons
   C01875  Undecan-2-one
BRITE hierarchy
Other DBs
CAS: 
112-12-9
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        12
            1   C1b C    23.3521  -15.1459
            2   C1b C    22.1341  -15.8419
            3   C1b C    24.5637  -15.8419
            4   C1b C    20.9224  -15.1459
            5   C1b C    25.7751  -15.1459
            6   C1b C    19.7044  -15.8419
            7   C5a C    26.9933  -15.8419
            8   C1b C    18.4928  -15.1459
            9   C1a C    26.9933  -17.5270
            10  O5a O    28.2048  -15.1459
            11  C1b C    17.2812  -15.8419
            12  C1a C    16.0632  -15.1459
BOND        11
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1
            7     6   8 1
            8     7   9 1
            9     7  10 2
            10    8  11 1
            11   11  12 1

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