KEGG   COMPOUND: C10659
Entry
C10659                      Compound                               
Name
Deoxyvasicinone;
2,3-Trimethylene-4-quinazolone
Formula
C11H10N2O
Exact mass
186.0793
Mol weight
186.2099
Structure
Other DBs
CAS: 530-53-0
PubChem: 12842
ChEBI: 4435
KNApSAcK: C00002150
3DMET: B04036
NIKKAJI: J324.098C
LinkDB
KCF data

ATOM        14
            1   N5x N    26.8278  -19.8025
            2   C8y C    26.8278  -17.0027
            3   C8y C    25.6197  -17.7026
            4   C8y C    25.6256  -19.1025
            5   C8x C    24.4163  -19.8076
            6   C8x C    23.2010  -19.1129
            7   C8x C    23.1949  -17.7130
            8   C8x C    24.4042  -17.0080
            9   C8y C    28.0431  -19.1025
            10  N4y N    28.0389  -17.6998
            11  C1x C    29.3717  -17.2623
            12  C1x C    30.1995  -18.3948
            13  C1x C    29.3784  -19.5320
            14  O5x O    26.8411  -15.6028
BOND        16
            1     4   5 1
            2     5   6 2
            3     6   7 1
            4     7   8 2
            5     8   3 1
            6     9   1 2
            7     1   4 1
            8     3   2 1
            9     2  10 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13   9 1
            15    3   4 2
            16    2  14 2

» Japanese version

DBGET integrated database retrieval system