KEGG   COMPOUND: C11634
Entry
C11634                      Compound                               

Name
Vellosimine
Formula
C19H20N2O
Exact mass
292.1576
Mol weight
292.3749
Structure
Reaction
Pathway
map00901  Indole alkaloid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C11634  Vellosimine
Other DBs
CAS: 6874-98-2
PubChem: 13799
ChEBI: 18057
KNApSAcK: C00045433 C00048226
NIKKAJI: J9.640G
KCF data

ATOM        22
            1   C8x C    13.2300  -14.2100
            2   C8x C    13.2300  -15.6100
            3   C8x C    14.4424  -16.3100
            4   C8y C    15.6549  -15.6100
            5   C8y C    15.6549  -14.2100
            6   C8x C    14.4424  -13.5100
            7   N4x N    16.8673  -16.3100
            8   C8y C    18.0797  -15.6100
            9   C8y C    18.0797  -14.2100
            10  C1y C    19.2922  -16.3100
            11  N1y N    20.5046  -15.6100
            12  C1y C    20.5046  -14.2100
            13  C1x C    19.2922  -13.5100
            14  C1x C    19.2922  -17.7100
            15  C1y C    20.5046  -18.4100
            16  C2y C    21.7170  -17.7100
            17  C1x C    21.7170  -16.3100
            18  C2b C    22.9295  -18.4100
            19  C1a C    22.9295  -19.8100
            20  C1y C    21.7170  -13.5100
            21  C4a C    23.0693  -13.1477
            22  O4a O    24.0592  -14.1376
BOND        26
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15    9  13 1
            16   10  14 1
            17   14  15 1
            18   15  16 1
            19   16  17 1
            20   11  17 1
            21   16  18 2
            22   18  19 1
            23   12  20 1 #Up
            24   15  20 1 #Up
            25   20  21 1 #Down
            26   21  22 2

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