KEGG   DRUG: Rintodestrant
Entry
D11736                      Drug                                   
Name
Rintodestrant (USAN)
Formula
C26H19FO5S
Exact mass
462.0937
Mol weight
462.49
Structure
Efficacy
Antineoplastic
Comment
Treatment of estrogen receptro (ER+) breast cancer
Other DBs
PubChem: 405226602
LinkDB
KCF data

ATOM        33
            1   C8y C    14.8400  -15.1200
            2   C8y C    14.8400  -13.7200
            3   C8x C    13.6500  -13.0200
            4   C8y C    12.3900  -13.7200
            5   C8x C    12.3900  -15.1200
            6   C8y C    13.6500  -15.8200
            7   X   F    11.2000  -13.0200
            8   C1a C    13.6500  -17.2200
            9   C1a C    16.0300  -13.0200
            10  C5a C    16.0300  -15.8200
            11  C8y C    17.2200  -15.1200
            12  C8y C    18.4800  -15.6800
            13  C8y C    19.3900  -14.7000
            14  C8y C    18.7600  -13.5100
            15  S2x S    17.3600  -13.7900
            16  C8x C    20.7900  -14.7000
            17  C8x C    21.4900  -13.4400
            18  C8y C    20.8600  -12.2500
            19  C8x C    19.4600  -12.2500
            20  O1a O    21.5600  -11.0600
            21  O2a O    18.7600  -17.0800
            22  C8y C    20.0900  -17.5000
            23  C8x C    20.0900  -18.9000
            24  C8x C    21.2800  -19.6000
            25  C8y C    22.5400  -18.9000
            26  C8x C    22.5400  -17.5000
            27  C8x C    21.3500  -16.8000
            28  C2b C    23.7300  -19.6000
            29  C2b C    24.9200  -18.9000
            30  C6a C    26.1100  -19.6000
            31  O6a O    27.3000  -18.9000
            32  O6a O    26.1100  -21.0000
            33  O5a O    16.0300  -17.2200
BOND        36
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     6   8 1
            9     2   9 1
            10    1  10 1
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   11  15 1
            17   13  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   14  19 2
            22   18  20 1
            23   12  21 1
            24   21  22 1
            25   22  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   22  27 1
            31   25  28 1
            32   28  29 2
            33   29  30 1
            34   30  31 1
            35   30  32 2
            36   10  33 2

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