KEGG   COMPOUND: C17756
Entry
C17756                      Compound                               

Name
2-Descarboxy-cyclo-dopa;
Indoline-5,6-diol;
5,6-Indolinediol
Formula
C8H9NO2
Exact mass
151.0633
Mol weight
151.1626
Structure
Reaction
Pathway
map00965  Betalain biosynthesis
Other DBs
CAS: 29539-03-5
PubChem: 96024083
ChEBI: 74683
NIKKAJI: J88.608D
KCF data

ATOM        11
            1   C8y C    25.4800  -20.6500
            2   C8y C    25.4800  -22.0500
            3   C8x C    26.6924  -22.7500
            4   C8y C    27.9049  -22.0500
            5   C8y C    27.9049  -20.6500
            6   C8x C    26.6924  -19.9500
            7   N1x N    29.2364  -22.4826
            8   C1x C    30.0593  -21.3500
            9   C1x C    29.2364  -20.2174
            10  O1a O    24.2676  -19.9500
            11  O1a O    24.2676  -22.7500
BOND        12
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    5   9 1
            11    1  10 1
            12    2  11 1

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