KEGG   COMPOUND: C10555Help
Entry
C10555                      Compound                               

Name
Deoxygomisin A;
(+)-gamma-Schizandrin
Formula
C23H28O6
Exact mass
400.1886
Mol weight
400.4648
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Lignans
   Lignans
    C10555  Deoxygomisin A
BRITE hierarchy
Other DBs
CAS: 82467-52-5
PubChem: 12738
ChEBI: 4410
ChEMBL: CHEMBL402435
KNApSAcK: C00002596 C00007216
3DMET: B03953
NIKKAJI: J1.033.305I
KCF data Show

ATOM        29
            1   C8y C    24.2288  -22.2490
            2   C8y C    24.2172  -23.6270
            3   C8y C    22.8744  -21.8291
            4   C8y C    25.1448  -21.3332
            5   C8y C    25.3035  -24.6084
            6   C8y C    23.0143  -23.9724
            7   C8y C    22.4484  -20.5326
            8   O2a O    21.6537  -22.3950
            9   C8x C    24.7247  -19.9026
            10  C1x C    26.5695  -21.3389
            11  C8x C    24.9523  -25.9805
            12  C1x C    26.6583  -24.6083
            13  C8y C    22.5942  -25.3971
            14  O2a O    21.6596  -23.3177
            15  C8y C    23.4401  -19.5338
            16  O2x O    21.1871  -19.8967
            17  C1a C    20.4449  -21.7531
            18  C1y C    27.4341  -22.1791
            19  C8y C    23.5976  -26.3655
            20  C1y C    27.4341  -23.7495
            21  O2a O    21.2279  -25.7531
            22  C1a C    20.2991  -24.0425
            23  O2x O    22.8101  -18.2785
            24  C1x C    21.4145  -18.5013
            25  C1a C    28.5787  -21.4031
            26  O2a O    23.2652  -27.7376
            27  C1a C    28.7595  -24.2467
            28  C1a C    20.8474  -27.1135
            29  C1a C    21.9104  -28.1357
BOND        32
            1     1   2 1
            2     1   3 2
            3     1   4 1 #Up
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 2
            13    6  14 1
            14    7  15 2
            15    7  16 1
            16    8  17 1
            17   10  18 1
            18   11  19 2
            19   12  20 1
            20   13  21 1
            21   14  22 1
            22   15  23 1
            23   16  24 1
            24   18  25 1 #Down
            25   19  26 1
            26   20  27 1 #Down
            27   21  28 1
            28   26  29 1
            29    9  15 1
            30   13  19 1
            31   18  20 1
            32   23  24 1

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