KEGG   COMPOUND: C10822Help
Entry
C10822                      Compound                               

Name
Solasodine
Formula
C27H43NO2
Exact mass
413.3294
Mol weight
413.6358
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01066  Biosynthesis of alkaloids derived from terpenoid and polyketide
Brite
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST01 Sterols
   ST0115 Solanidines and alkaloid derivatives
    C10822  Solasodine
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived by amination reactions
   Steroid alkaloids
    C10822  Solasodine
BRITE hierarchy
Other DBs
CAS: 126-17-0
PubChem: 13005
ChEBI: 9190
ChEMBL: CHEMBL518252
LipidBank: SST0119
KNApSAcK: C00002264
3DMET: B04156
NIKKAJI: J59.535G
LinkDB All DBs
KCF data Show

ATOM        30
            1   C1y C    27.7443  -19.9261
            2   C1y C    28.8979  -20.5961
            3   C1y C    27.7501  -18.5832
            4   C1x C    28.9329  -21.9317
            5   O2x O    30.0357  -19.9318
            6   C1z C    30.0415  -18.5832
            7   C1a C    26.7920  -17.6450
            8   C1x C    31.1964  -19.2604
            9   N1x N    30.0415  -17.2604
            10  C1x C    32.3455  -18.5832
            11  C1x C    31.2023  -16.6018
            12  C1y C    32.3572  -17.2661
            13  C1a C    33.5124  -16.6018
            14  C1y C    26.5646  -21.9031
            15  C1z C    26.5646  -20.5723
            16  C1x C    25.4027  -19.8416
            17  C1y C    25.3794  -22.5651
            18  C1x C    24.2119  -20.5093
            19  C1y C    24.2002  -21.8741
            20  C1x C    25.3794  -23.9294
            21  C1z C    23.0221  -22.5534
            22  C2x C    24.1885  -24.6089
            23  C2y C    23.0162  -23.9179
            24  C1x C    21.8441  -21.8681
            25  C1a C    23.0105  -21.1888
            26  C1x C    21.8441  -24.6030
            27  C1x C    20.6588  -22.5534
            28  C1y C    20.6588  -23.9179
            29  O1a O    19.4679  -24.6030
            30  C1a C    26.4996  -19.1637
BOND        35
            1    15   1 1
            2     1   2 1
            3     1   3 1
            4    14   4 1
            5     2   5 1
            6     3   6 1
            7     3   7 1 #Down
            8     6   8 1 #Up
            9     6   9 1 #Down
            10    8  10 1
            11    9  11 1
            12   10  12 1
            13   12  13 1 #Down
            14    2   4 1
            15    5   6 1
            16   11  12 1
            17   14  17 1
            18   16  18 1
            19   17  19 1
            20   17  20 1
            21   19  21 1
            22   20  22 1
            23   21  23 1
            24   21  24 1
            25   21  25 1 #Up
            26   23  26 1
            27   24  27 1
            28   26  28 1
            29   28  29 1 #Up
            30   18  19 1
            31   22  23 2
            32   27  28 1
            33   15  30 1 #Up
            34   15  14 1
            35   15  16 1

» Japanese version

DBGET integrated database retrieval system