KEGG   COMPOUND: C09736
Entry
C09736                      Compound                               

Name
Fisetinidol-4beta-ol;
(-)-Mollisacacidin;
Fisetinin-3,4-diol;
5-Deoxyleucocyanidin
Formula
C15H14O6
Exact mass
290.079
Mol weight
290.2681
Structure
Reaction
Pathway
map00941  Flavonoid biosynthesis
Enzyme
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1202 Flavans, Flavanols and Leucoanthocyanidins
    C09736  Fisetinidol-4beta-ol
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavan 3,4-diols
    C09736  5-Deoxyleucocyanidin
Other DBs
CAS: 967-30-6
PubChem: 11924
ChEBI: 5067
KNApSAcK: C00000962
3DMET: B03235
NIKKAJI: J2.019.002G
KCF data

ATOM        21
            1   C1y C    29.4545  -17.3072
            2   O2x O    28.2425  -16.5962
            3   C1y C    29.4487  -18.7058
            4   C8y C    27.0303  -17.2955
            5   C1y C    28.2308  -19.3992
            6   O1a O    30.6550  -19.4108
            7   C8y C    27.0245  -18.6999
            8   C8x C    25.8183  -16.5905
            9   O1a O    28.2249  -20.7920
            10  C8x C    25.8183  -19.3934
            11  C8y C    24.6063  -17.2955
            12  C8x C    24.6063  -18.6999
            13  O1a O    23.4000  -16.6022
            14  C8y C    30.6724  -16.6079
            15  C8x C    30.6724  -15.2093
            16  C8x C    31.8846  -17.3189
            17  C8y C    31.8903  -14.5100
            18  C8x C    33.1025  -16.6196
            19  C8y C    33.1025  -15.2152
            20  O1a O    31.8963  -13.1115
            21  O1a O    34.3145  -14.5217
BOND        23
            1     5   9 1 #Up
            2     7  10 1
            3     8  11 2
            4    10  12 2
            5    11  13 1
            6     5   7 1
            7    11  12 1
            8     1  14 1 #Down
            9     1   2 1
            10    1   3 1
            11    2   4 1
            12    3   5 1
            13    3   6 1 #Up
            14    4   7 2
            15    4   8 1
            16   14  15 1
            17   14  16 2
            18   15  17 2
            19   16  18 1
            20   17  19 1
            21   17  20 1
            22   19  21 1
            23   18  19 2

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