KEGG   COMPOUND: C12056Help
Entry
C12056                      Compound                               

Name
Actinonin
Formula
C19H35N3O5
Exact mass
385.2577
Mol weight
385.4983
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 13434-13-4
PubChem: 14211
ChEMBL: CHEMBL117720 CHEMBL308333
KNApSAcK: C00017730
PDB-CCD: BB2[PDBj]
NIKKAJI: J81.901H
KCF data Show

ATOM        27
            1   C1x C    34.0738  -22.9877
            2   C1x C    34.5098  -21.6564
            3   C1y C    33.3734  -20.8301
            4   N1y N    32.2373  -21.6564
            5   C1x C    32.6731  -22.9877
            6   O1b O    21.3474  -20.9503
            7   N1b N    22.5571  -21.6507
            8   C5a C    23.7668  -20.9503
            9   C1b C    24.9765  -21.6507
            10  C1c C    26.1861  -20.9503
            11  C5a C    27.3958  -21.6507
            12  N1b N    28.6055  -20.9503
            13  C1c C    29.8152  -21.6507
            14  C5a C    31.0249  -20.9503
            15  O5a O    23.7668  -19.5497
            16  C1b C    26.1861  -19.5497
            17  C1b C    24.9731  -18.8493
            18  C1b C    24.9731  -17.4486
            19  C1b C    23.7602  -16.7483
            20  C1a C    23.7602  -15.3476
            21  O5a O    27.3958  -22.9114
            22  C1c C    29.8152  -23.0514
            23  C1a C    28.6021  -23.7517
            24  C1a C    31.0283  -23.7517
            25  O5a O    31.0249  -19.6897
            26  C1b C    33.3593  -19.4294
            27  O1a O    32.1393  -18.6013
BOND        27
            1    14   4 1
            2     3   2 1
            3     8  15 2
            4     7   8 1
            5    10  16 1 #Up
            6     3   4 1
            7    16  17 1
            8     8   9 1
            9    17  18 1
            10    4   5 1
            11   18  19 1
            12    9  10 1
            13   19  20 1
            14    5   1 1
            15   11  21 2
            16   10  11 1
            17   13  22 1 #Down
            18   22  23 1
            19   11  12 1
            20   22  24 1
            21    1   2 1
            22   14  25 2
            23   12  13 1
            24    3  26 1
            25    6   7 1
            26   26  27 1
            27   13  14 1

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