KEGG   COMPOUND: C10011Help
Entry
C10011                      Compound                               

Name
Nummularine F
Formula
C23H32N4O4
Exact mass
428.2424
Mol weight
428.5246
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 58775-98-7
PubChem: 12197
ChEBI: 7658
KNApSAcK: C00002006
3DMET: B03457
NIKKAJI: J2.771.531A
KCF data Show

ATOM        31
            1   C5a C    26.4900  -21.9427
            2   C1b C    26.4910  -23.1539
            3   O5a O    27.5911  -21.1260
            4   N1c N    25.1968  -23.9518
            5   C5x C    26.8506  -18.8031
            6   N1x N    28.0188  -19.4716
            7   C1y C    29.1871  -18.7960
            8   C1c C    30.3554  -19.4645
            9   C1b C    31.5236  -18.7889
            10  C8x C    25.4569  -14.5486
            11  C8y C    25.4569  -15.8999
            12  C8x C    26.6313  -16.5755
            13  C8x C    27.7988  -15.8999
            14  C8y C    27.7988  -14.5486
            15  C8x C    26.6313  -13.8730
            16  C2x C    28.9708  -13.9440
            17  O2x O    24.4955  -16.7862
            18  C2x C    30.3688  -14.8461
            19  N1x N    30.3661  -16.7856
            20  C5x C    29.1840  -17.4447
            21  O5x O    26.8476  -17.4518
            22  O5x O    28.0166  -16.7620
            23  C1y C    25.6721  -19.4756
            24  C1y C    24.5095  -18.7951
            25  C1x C    23.5002  -19.6895
            26  C1x C    24.0430  -20.9259
            27  N1y N    25.3823  -20.9294
            28  C1a C    30.3584  -20.8158
            29  C1a C    32.6961  -19.4631
            30  C1a C    25.2063  -25.2950
            31  C1a C    23.9571  -23.4032
BOND        33
            1     8   9 1
            2    16  18 2
            3    23   5 1
            4    18  19 1
            5     1   3 2
            6     7  20 1
            7    20  19 1
            8     5   6 1
            9     5  21 2
            10    1   2 1
            11   20  22 2
            12    6   7 1
            13    2   4 1
            14   10  11 1
            15   11  12 2
            16   12  13 1
            17   23  24 1
            18   24  25 1
            19   25  26 1
            20   26  27 1
            21   27  23 1
            22   17  24 1
            23   27   1 1
            24   13  14 2
            25   14  15 1
            26   15  10 2
            27    7   8 1
            28    8  28 1 #Down
            29   14  16 1
            30    9  29 1
            31    4  30 1
            32   11  17 1
            33    4  31 1

» Japanese version

DBGET integrated database retrieval system