KEGG   COMPOUND: C03309Help
Entry
C03309                      Compound                               

Name
Strictosidine aglycone
Formula
C21H24N2O4
Exact mass
368.1736
Mol weight
368.4263
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Indole alkaloid biosynthesis
Metabolic pathways
Biosynthesis of secondary metabolites
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C03309  Strictosidine aglycone
BRITE hierarchy
Other DBs
CAS: 
85925-13-9
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        27
            1   C1y C    27.3399  -15.9144
            2   N1x N    28.5331  -15.2273
            3   C1x C    28.5321  -13.8598
            4   C1x C    27.3515  -13.1737
            5   C1y C    28.5255  -20.2781
            6   C1y C    28.5255  -18.9398
            7   C1y C    29.6706  -20.9595
            8   C2b C    27.3729  -20.9420
            9   C2y C    29.6706  -18.2703
            10  C1b C    27.3448  -18.2560
            11  O1a O    29.6779  -22.3256
            12  O2x O    30.8348  -20.2781
            13  C2a C    26.2264  -20.2664
            14  C2x C    30.8348  -18.9398
            15  C7a C    29.6648  -16.9495
            16  O7a O    30.8172  -16.2868
            17  O6a O    28.5138  -16.2928
            18  C1a C    31.9637  -16.9495
            19  C8y C    26.1524  -15.2188
            20  C8y C    26.1642  -13.8481
            21  N4x N    24.9681  -15.9048
            22  C8y C    23.7818  -15.1983
            23  C8y C    23.8005  -13.8317
            24  C8x C    22.6308  -13.1357
            25  C8x C    21.4355  -13.7995
            26  C8x C    21.4170  -15.1732
            27  C8x C    22.5936  -15.8692
BOND        30
            1     5   8 1
            2     6   9 1
            3     6  10 1
            4     7  11 1 #Up
            5     7  12 1
            6     8  13 2
            7     9  14 2
            8     9  15 1
            9    15  16 1
            10   15  17 2
            11   16  18 1
            12   12  14 1
            13   10   1 1
            14   19  20 2
            15   20   4 1
            16    3   4 1
            17   22  21 1
            18   21  19 1
            19   20  23 1
            20    1  19 1
            21    1   2 1
            22    2   3 1
            23    5   6 1
            24    5   7 1
            25   22  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   27  22 1

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