KEGG   COMPOUND: C10645
Entry
C10645                      Compound                               
Name
Atalaphylline
Formula
C23H25NO4
Exact mass
379.1784
Mol weight
379.4489
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Acridone alkaloids
    C10645  Atalaphylline
Other DBs
CAS: 28233-35-4
PubChem: 12828
ChEBI: 2903
KNApSAcK: C00002139
3DMET: B04024
NIKKAJI: J21.545G
LinkDB
KCF data

ATOM        28
            1   C1b C    26.6814  -19.1381
            2   C2b C    27.8931  -19.8287
            3   C2c C    27.8931  -21.2235
            4   C1a C    29.0978  -21.9210
            5   C1a C    26.6744  -21.9210
            6   N4x N    24.2783  -17.7363
            7   C8y C    24.2783  -14.9324
            8   C8y C    25.4892  -15.6298
            9   C8y C    25.4833  -17.0318
            10  C8y C    26.6952  -17.7414
            11  C8y C    27.9132  -17.0421
            12  C8y C    27.9193  -15.6401
            13  C8y C    26.7072  -14.9377
            14  O5x O    24.2651  -13.5305
            15  O1a O    29.1119  -17.7363
            16  C8y C    23.0604  -17.0318
            17  C8y C    23.0645  -15.6271
            18  C8x C    21.8492  -14.9246
            19  C8x C    20.6294  -15.6198
            20  C8x C    20.6254  -17.0245
            21  C8y C    21.8407  -17.7341
            22  O1a O    21.8276  -19.1312
            23  O1a O    26.7656  -13.5305
            24  C1b C    29.1190  -14.9466
            25  C2b C    30.3307  -15.6440
            26  C2c C    31.5423  -14.9536
            27  C1a C    32.7541  -15.6509
            28  C1a C    31.5354  -13.5517
BOND        30
            1     7  14 2
            2     8   7 1
            3    11  15 1
            4     7  17 1
            5     3   4 1
            6     3   5 1
            7     2   3 2
            8     1   2 1
            9    16  17 2
            10   17  18 1
            11   18  19 2
            12   19  20 1
            13   20  21 2
            14   21  16 1
            15   16   6 1
            16   21  22 1
            17   10   1 1
            18    8   9 2
            19    9  10 1
            20   13  23 1
            21   10  11 2
            22   12  24 1
            23   11  12 1
            24   24  25 1
            25   12  13 2
            26   25  26 2
            27   13   8 1
            28   26  27 1
            29    6   9 1
            30   26  28 1

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