KEGG   COMPOUND: C19982
Entry
C19982                      Compound                               
Name
Gelsedine;
(Spiro(3H-indole-3,7'(6'H)-(3,) (6)methano(1H)oxepino(4,3-b)pyrrol)-2(1H)-one,) 2'-ethyl-2',3',3'a, 4',8',8'a-hexahydro-1-methoxy-
Formula
C19H24N2O3
Exact mass
328.1787
Mol weight
328.40
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C19982  Gelsedine
Natural toxins [BR:br08009]
 Phytotoxins
  Alkaloids
   Indole alkaloids
    C19982  Gelsedine
Other DBs
CAS: 7096-96-0
PubChem: 135626448
KNApSAcK: C00025088
LinkDB
KCF data

ATOM        24
            1   C1y C    26.5300  -16.1000
            2   C1y C    27.5800  -15.2600
            3   C1x C    26.4600  -17.4300
            4   C1z C    27.5100  -18.2700
            5   C1y C    28.8400  -17.9900
            6   C8x C    23.9400  -18.6900
            7   C8x C    23.9400  -20.0200
            8   C8x C    25.1300  -20.6500
            9   C8x C    25.1300  -17.9900
            10  C8y C    26.2500  -18.6900
            11  C8y C    26.2500  -20.0200
            12  N1y N    27.5100  -20.4400
            13  C5x C    28.2800  -19.3200
            14  O2a O    27.5100  -21.7700
            15  C1a C    28.7000  -22.4000
            16  O5x O    29.6100  -19.3200
            17  C1x C    28.8400  -15.6100
            18  O2x O    29.4000  -16.8000
            19  C1y C    27.1056  -14.0718
            20  C1y C    25.7624  -14.0642
            21  N1x N    25.4066  -15.3610
            22  C1b C    24.8897  -12.9734
            23  C1a C    23.5388  -13.1787
            24  C1x C    27.4277  -17.1977
BOND        28
            1    12  13 1
            2     4  13 1 #Down
            3     4  10 1 #Up
            4     1   3 1
            5     1   2 1
            6     3   4 1
            7    12  14 1
            8     6   7 1
            9    14  15 1
            10    7   8 2
            11   13  16 2
            12    8  11 1
            13   10   9 1
            14    9   6 2
            15    2  17 1
            16   18   5 1
            17   17  18 1
            18    4   5 1
            19   10  11 2
            20   11  12 1
            21    2  19 1
            22   19  20 1
            23   20  21 1
            24    1  21 1
            25   20  22 1 #Down
            26   22  23 1
            27    5  24 1 #Down
            28   19  24 1 #Down

» Japanese version

DBGET integrated database retrieval system