KEGG   COMPOUND: C08501
Entry
C08501                      Compound                               
Name
gamma-Nonalactone;
delta-n-Amylbutyrolactone;
Dihydro-5-pentyl-2(3H)-furanone
Formula
C9H16O2
Exact mass
156.115
Mol weight
156.2221
Structure
Other DBs
CAS: 104-61-0
PubChem: 10694
ChEBI: 10575
KNApSAcK: C00001318
NIKKAJI: J2.412K
KCF data

ATOM        11
            1   C1y C    29.2272  -19.3085
            2   O7x O    30.3677  -18.4896
            3   C1x C    29.6658  -20.6478
            4   C1b C    28.0165  -18.6124
            5   C7x C    31.5022  -19.3143
            6   C1x C    31.0636  -20.6478
            7   C1b C    26.8058  -19.3085
            8   O6a O    32.8299  -18.8874
            9   C1b C    25.5951  -18.6124
            10  C1b C    24.3785  -19.3085
            11  C1a C    23.1678  -18.6124
BOND        11
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     5   8 2
            8     7   9 1
            9     9  10 1
            10   10  11 1
            11    5   6 1

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Chemical substance (7)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   HSDB (1)   
   KNApSAcK (1)   
   MASSBANK (1)   
   NIKKAJI (1)   
All databases (7)   

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