KEGG   COMPOUND: C10670Help
Entry
C10670                      Compound                               

Name
Evoxine;
2,3-Butanediol, 1-((4,8-dimethoxyfuro(2,3-b)quinolin-7-yl)oxy)-3-methyl-, (+)-
Formula
C18H21NO6
Exact mass
347.1369
Mol weight
347.3624
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Quinoline alkaloids
    C10670  Evoxine
BRITE hierarchy
Other DBs
CAS: 522-11-2
PubChem: 12853
ChEBI: 4952
ChEMBL: CHEMBL1416006
KNApSAcK: C00002158
3DMET: B05462
NIKKAJI: J11.707B
LinkDB All DBs
KCF data Show

ATOM        25
            1   N5x N    29.8575  -19.1209
            2   C8y C    29.8575  -16.3176
            3   C8y C    28.6470  -17.0149
            4   C8y C    28.6529  -18.4166
            5   C8y C    27.4411  -19.1261
            6   C8y C    26.2233  -18.4270
            7   C8x C    26.2174  -17.0252
            8   C8x C    27.4292  -16.3229
            9   C8y C    31.0682  -18.4166
            10  C8y C    31.0642  -17.0121
            11  C8x C    32.3989  -16.5763
            12  C8x C    33.2306  -17.7116
            13  O2x O    32.4057  -18.8516
            14  O2a O    25.0180  -19.1280
            15  C1b C    23.8065  -18.4236
            16  C1c C    22.5949  -19.1280
            17  C1d C    21.3836  -18.4236
            18  C1a C    20.1791  -19.1280
            19  O2a O    27.4480  -20.5155
            20  C1a C    28.6594  -21.2059
            21  O2a O    29.8638  -14.9230
            22  C1a C    28.6524  -14.2186
            23  O1a O    22.6020  -20.5297
            24  C1a C    21.3205  -17.0220
            25  O1a O    20.1791  -17.7193
BOND        27
            1    10  11 1
            2    11  12 2
            3    12  13 1
            4    13   9 1
            5     3   4 2
            6     6  14 1
            7     4   5 1
            8    14  15 1
            9     5   6 2
            10   15  16 1
            11    6   7 1
            12   16  17 1
            13    7   8 2
            14   17  18 1
            15    8   3 1
            16    5  19 1
            17    9   1 2
            18   19  20 1
            19    1   4 1
            20    2  21 1
            21    3   2 1
            22   21  22 1
            23    2  10 2
            24   16  23 1
            25   17  24 1
            26    9  10 1
            27   17  25 1

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