KEGG   COMPOUND: C20044Help
Entry
C20044                      Compound                               

Name
Enanthotoxin;
Oenanthotoxin
Formula
C17H22O2
Exact mass
258.162
Mol weight
258.3554
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Fatty acids related compounds
  Fatty acids
   Polyynes
    C20044  Enanthotoxin
Natural toxins [BR:br08009]
 Phytotoxins
  Others
   Polyynes
    C20044  Enanthotoxin
BRITE hierarchy
Other DBs
CAS: 20311-78-8
PubChem: 135626510
ChEMBL: CHEMBL550225
KNApSAcK: C00048029
LinkDB All DBs
KCF data Show

ATOM        19
            1   C1a C    10.1500  -17.2900
            2   C1b C    11.3624  -16.5900
            3   C1b C    12.5749  -17.2900
            4   C1c C    13.7873  -16.5900
            5   C1b C    14.9997  -17.2900
            6   C1b C    16.2122  -16.5900
            7   C2b C    17.4246  -17.2900
            8   C2b C    18.6370  -16.5900
            9   C2b C    19.8495  -17.2900
            10  C2b C    21.0846  -16.5766
            11  O1a O    13.7873  -15.1900
            12  C3b C    22.2919  -17.2734
            13  C3b C    23.5043  -17.9734
            14  C3b C    24.7167  -18.6734
            15  C3b C    25.9292  -19.3734
            16  C2b C    27.1416  -20.0734
            17  C2b C    28.3604  -19.3696
            18  C1b C    29.5738  -20.0700
            19  O1a O    30.7521  -19.3895
BOND        18
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 2
            8     8   9 1
            9     9  10 2
            10    4  11 1 #Up
            11   10  12 1
            12   12  13 3
            13   13  14 1
            14   14  15 3
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   18  19 1

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