KEGG   COMPOUND: C11846
Entry
C11846                      Compound                               
Name
Cyclo(deltaAla-L-Val)
Formula
C8H12N2O2
Exact mass
168.0899
Mol weight
168.1931
Structure
Other DBs
PubChem: 14008
ChEBI: 29563
NIKKAJI: J1.213.649H
LinkDB
KCF data

ATOM        12
            1   N1x N    29.8129  -18.8184
            2   C5x C    28.5972  -18.1245
            3   C1y C    27.3850  -18.8245
            4   N1x N    27.3885  -20.2250
            5   C5x C    28.6042  -20.9259
            6   C2y C    29.8164  -20.2190
            7   C2a C    31.0408  -20.9046
            8   O5x O    28.6303  -22.3239
            9   O5x O    28.6648  -16.7241
            10  C1c C    26.1780  -18.1277
            11  C1a C    26.1755  -16.7274
            12  C1a C    24.9709  -18.8308
BOND        12
            1     6   7 2
            2     1   2 1
            3     5   8 2
            4     2   3 1
            5     2   9 2
            6     3   4 1
            7     3  10 1 #Up
            8     4   5 1
            9    10  11 1
            10    5   6 1
            11   10  12 1
            12    6   1 1

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