KEGG   COMPOUND: C18012
Entry
C18012                      Compound                               

Name
Flaviolin;
2,5,7-Trihydroxy-1,4-naphthalenedione;
4,5,7-Trihydroxynaphthalene-1,2-dione
Formula
C10H6O5
Exact mass
206.0215
Mol weight
206.1516
Structure
Reaction
Enzyme
1.14.19.69      2.5.1.123
Other DBs
CAS: 479-05-0
PubChem: 96024232
ChEBI: 42646
ChEMBL: CHEMBL1232770
PDB-CCD: FLV[PDBj]
NIKKAJI: J12.547D
LinkDB
KCF data

ATOM        15
            1   C2x C    22.7500  -18.6900
            2   C2y C    22.7500  -20.0900
            3   C5x C    21.5600  -20.7900
            4   C8y C    20.3000  -20.0900
            5   C8y C    20.3000  -18.6900
            6   C5x C    21.5600  -17.9900
            7   C8x C    19.1100  -20.7900
            8   C8y C    17.9200  -20.0900
            9   C8x C    17.9200  -18.6900
            10  C8y C    19.1100  -17.9900
            11  O5x O    21.5600  -16.5900
            12  O5x O    21.5600  -22.1900
            13  O1a O    23.9400  -20.7900
            14  O1a O    16.7300  -20.7900
            15  O1a O    19.1100  -16.5900
BOND        16
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    6  11 2
            13    3  12 2
            14    2  13 1
            15    8  14 1
            16   10  15 1

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