KEGG   COMPOUND: C06051
Entry
C06051                      Compound                               
Name
Isopyridoxal
Formula
C8H9NO3
Exact mass
167.0582
Mol weight
167.162
Structure
Reaction
R01910 R05084 R07154 R12265
Pathway
map00750  Vitamin B6 metabolism
Enzyme
1.1.1.416       1.1.99.9        1.2.1.102
Other DBs
CAS: 6560-46-9
PubChem: 8322
ChEBI: 17889
3DMET: B00893
NIKKAJI: J100.295C
LinkDB
KCF data

ATOM        12
            1   C8y C    24.8849  -17.1915
            2   C8y C    26.0967  -17.8847
            3   C8y C    23.6730  -17.8847
            4   C1b C    24.8674  -15.7874
            5   C8x C    26.0967  -19.2830
            6   C4a C    27.3087  -17.1798
            7   C8y C    23.6730  -19.2830
            8   O1a O    22.4553  -17.1915
            9   O1a O    23.6613  -15.0823
            10  N5x N    24.8849  -19.9881
            11  O4a O    27.3028  -15.7815
            12  C1a C    22.4553  -19.9822
BOND        12
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 2
            10    6  11 2
            11    7  12 1
            12    7  10 1

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