KEGG   COMPOUND: C08864Help
Entry
C08864                      Compound                               

Name
Divostroside;
Sarmentogenin 3-O-alpha-L-diginoside
Formula
C30H46O8
Exact mass
534.3193
Mol weight
534.6814
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Steroids
   Cardanolide
    C08864  Divostroside
BRITE hierarchy
Other DBs
CAS: 76704-78-4
PubChem: 11057
ChEBI: 4669
KNApSAcK: C00003620
3DMET: B02473
NIKKAJI: J74.574J
KCF data Show

ATOM        38
            1   C1y C    22.1363  -20.1469
            2   C1x C    22.0960  -21.5312
            3   O2x O    20.9670  -19.4225
            4   C1y C    20.8790  -22.1791
            5   C1y C    19.7447  -20.0810
            6   C1y C    19.7066  -21.4596
            7   O2a O    20.8393  -23.5622
            8   C1a C    18.5756  -19.3566
            9   O1a O    18.4911  -22.1073
            10  C1a C    19.6171  -24.2073
            11  C1z C    30.5038  -16.7219
            12  C1y C    29.3088  -17.4031
            13  C1z C    30.5212  -15.3524
            14  C1x C    32.8819  -16.7509
            15  O1a O    30.4922  -18.0915
            16  C1y C    28.1258  -16.7043
            17  C1x C    29.3088  -18.7786
            18  C1y C    31.7163  -14.6815
            19  C1x C    29.3321  -14.6523
            20  C1a C    30.5096  -13.9711
            21  C1x C    32.8993  -15.3815
            22  C1z C    26.9262  -17.3914
            23  C1y C    28.1374  -15.3291
            24  C1x C    28.1141  -19.4611
            25  C2y C    31.7279  -13.3003
            26  C1y C    26.9205  -18.7669
            27  C1x C    25.7371  -16.6986
            28  C1a C    26.9146  -16.0103
            29  O1a O    26.9495  -14.6290
            30  C2x C    33.1031  -13.3003
            31  C1x C    31.3086  -11.9891
            32  C1x C    25.7371  -19.4611
            33  C1x C    24.5363  -17.3914
            34  C7x C    33.5224  -11.9891
            35  O7x O    32.4219  -11.1912
            36  C1y C    24.5363  -18.7669
            37  O6a O    34.8338  -11.5639
            38  O2a O    23.3474  -19.4611
BOND        43
            1     5   6 1
            2     1   2 1
            3     1   3 1
            4     2   4 1
            5     3   5 1
            6     4   6 1
            7     4   7 1 #Down
            8     5   8 1 #Down
            9     6   9 1 #Down
            10   11  12 1
            11   11  13 1
            12   11  14 1
            13   11  15 1 #Up
            14   12  16 1
            15   12  17 1
            16   13  18 1
            17   13  19 1
            18   13  20 1 #Up
            19   14  21 1
            20   16  22 1
            21   16  23 1
            22   17  24 1
            23   18  25 1
            24   22  26 1
            25   22  27 1
            26   22  28 1 #Up
            27   23  29 1 #Down
            28   25  30 2
            29   25  31 1
            30   26  32 1
            31   27  33 1
            32   30  34 1
            33   31  35 1
            34   32  36 1
            35   34  37 2
            36   36  38 1 #Up
            37   18  21 1
            38   19  23 1
            39   24  26 1
            40   33  36 1
            41   34  35 1
            42    1  38 1 #Up
            43    7  10 1

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