KEGG   COMPOUND: C09970
Entry
C09970                      Compound                               

Name
Tephrowatsin A
Formula
C22H26O4
Exact mass
354.1831
Mol weight
354.4394
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1202 Flavans, Flavanols and Leucoanthocyanidins
    C09970  Tephrowatsin A
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavan 4-ols
    C09970  Tephrowatsin A
Other DBs
CAS: 97640-79-4
PubChem: 12156
ChEBI: 9443
KNApSAcK: C00001009
3DMET: B03422
NIKKAJI: J2.771.412I
KCF data

ATOM        26
            1   C8y C    25.8633  -21.9391
            2   C8y C    25.7992  -20.5354
            3   C8y C    24.5878  -22.6379
            4   C1y C    26.9988  -22.6437
            5   C8y C    24.5878  -19.8425
            6   O2x O    27.0104  -19.8425
            7   C8x C    23.3708  -21.9391
            8   O2a O    24.5937  -24.0414
            9   C1x C    28.2159  -21.9448
            10  O1a O    26.9930  -24.0473
            11  C8y C    23.3708  -20.5354
            12  C1b C    24.5937  -18.4391
            13  C1y C    28.2219  -20.5471
            14  C1a C    23.3824  -24.7402
            15  O2a O    22.1593  -19.8366
            16  C2b C    25.8049  -17.7402
            17  C1a C    20.9481  -20.5354
            18  C2c C    25.8049  -16.3366
            19  C1a C    27.0163  -15.6436
            20  C1a C    24.5937  -15.6377
            21  C8y C    29.4311  -19.8550
            22  C8x C    30.6445  -20.5588
            23  C8x C    29.3690  -18.4565
            24  C8x C    31.8615  -19.8716
            25  C8x C    30.6562  -17.7576
            26  C8x C    31.8674  -18.4681
BOND        28
            1     3   7 2
            2     3   8 1
            3     4   9 1
            4     4  10 1 #Up
            5     5  11 2
            6     5  12 1
            7     6  13 1
            8     8  14 1
            9    11  15 1
            10   12  16 1
            11   15  17 1
            12   16  18 2
            13   18  19 1
            14   18  20 1
            15    7  11 1
            16    9  13 1
            17   13  21 1 #Down
            18    1   2 2
            19    1   3 1
            20    1   4 1
            21    2   5 1
            22    2   6 1
            23   21  22 2
            24   21  23 1
            25   22  24 1
            26   23  25 2
            27   24  26 2
            28   25  26 1

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