KEGG   COMPOUND: C14390
Entry
C14390                      Compound                               
Name
Heptanal;
n-Heptaldehyde
Formula
C7H14O
Exact mass
114.1045
Mol weight
114.1855
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA06 Fatty aldehydes
   C14390  Heptanal
Other DBs
CAS: 111-71-7
PubChem: 17395390
ChEBI: 34787
KNApSAcK: C00034880
NIKKAJI: J5.520D
KCF data

ATOM        8
            1   O4a O    24.1500  -17.6401
            2   C4a C    25.3624  -18.3401
            3   C1b C    26.5749  -17.6401
            4   C1b C    27.7874  -18.3401
            5   C1b C    28.9998  -17.6401
            6   C1b C    30.2123  -18.3401
            7   C1b C    31.4247  -17.6401
            8   C1a C    32.6371  -18.3401
BOND        7
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1

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