KEGG   COMPOUND: C08538
Entry
C08538                      Compound                               

Name
Betalamic acid
Formula
C9H9NO5
Exact mass
211.0481
Mol weight
211.1715
Structure
Reaction
Pathway
map00965  Betalain biosynthesis
map01110  Biosynthesis of secondary metabolites
Brite
Phytochemical compounds [BR:br08003]
 Amino acid related compounds
  Betalains
   Others
    C08538  Betalamic acid
Other DBs
CAS: 18766-66-0
PubChem: 10731
ChEBI: 27483
ChEMBL: CHEMBL2062984
KNApSAcK: C00001582
3DMET: B02208
NIKKAJI: J373.303C
KCF data

ATOM        15
            1   C2y C    26.0106  -18.9249
            2   C1x C    24.7871  -19.6124
            3   C2x C    27.2108  -19.6298
            4   C2b C    26.0164  -17.5323
            5   C1y C    24.7755  -21.0108
            6   C2y C    27.1991  -21.0341
            7   C4a C    24.8105  -16.8216
            8   N1x N    25.9873  -21.7274
            9   C6a C    23.5577  -21.7041
            10  C6a C    28.3995  -21.7450
            11  O4a O    24.7988  -15.4173
            12  O6a O    22.3574  -20.9932
            13  O6a O    23.6102  -23.1083
            14  O6a O    28.4519  -23.1491
            15  O6a O    29.6172  -21.0515
BOND        15
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     5   8 1
            8     5   9 1 #Down
            9     6  10 1
            10    7  11 2
            11    9  12 1
            12    9  13 2
            13   10  14 1
            14   10  15 2
            15    6   8 1

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