KEGG   COMPOUND: C13793
Entry
C13793                      Compound                               
Name
3-Bromo-2Z-heptenoic acid;
3-Bromo-2Z-heptenoate;
(2Z)-3-Bromoheptenoic acid
Formula
C7H11BrO2
Exact mass
205.9942
Mol weight
207.065
Structure
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0109 Halogenated fatty acids
    C13793  (2Z)-3-Bromoheptenoic acid
Other DBs
PubChem: 854038
ChEBI: 34329
LIPIDMAPS: LMFA01090001
NIKKAJI: J2.786.442B
LinkDB
KCF data

ATOM        10
            1   O6a O    24.7101  -18.2001
            2   C6a C    25.9226  -17.5000
            3   C2b C    27.1350  -18.2001
            4   C2c C    28.3475  -17.5000
            5   C1b C    29.5599  -18.2001
            6   C1b C    30.7723  -17.5000
            7   C1b C    31.9848  -18.2001
            8   C1a C    33.1972  -17.5000
            9   O6a O    25.9226  -16.1000
            10  X   Br   28.3475  -16.1000
BOND        9
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     2   9 2
            9     4  10 1

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