KEGG   COMPOUND: C17144
Entry
C17144                      Compound                               
Name
3-Octanol
Formula
C8H18O
Exact mass
130.1358
Mol weight
130.2279
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA05 Fatty alcohols
   C17144  3-Octanol
Other DBs
CAS: 589-98-0
PubChem: 96023596
ChEBI: 80945
LIPIDMAPS: LMFA05000568
KNApSAcK: C00035495
NIKKAJI: J43.433G
LinkDB
KCF data

ATOM        9
            1   C1a C    24.5224  -19.3900
            2   C1b C    25.7349  -20.0900
            3   C1c C    26.9473  -19.3900
            4   C1b C    28.1597  -20.0900
            5   C1b C    29.3722  -19.3900
            6   C1b C    30.5846  -20.0900
            7   C1b C    31.7970  -19.3900
            8   C1a C    33.0095  -20.0900
            9   O1a O    26.9473  -17.9900
BOND        8
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     3   9 1

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