KEGG   COMPOUND: C10766
Entry
C10766                      Compound                               
Name
Ascosalitoxin
Formula
C15H20O4
Exact mass
264.1362
Mol weight
264.3169
Structure
Other DBs
CAS: 152982-97-3
PubChem: 12949
ChEBI: 2870
KNApSAcK: C00002639
3DMET: B05482
NIKKAJI: J2.779.452A
LinkDB
KCF data

ATOM        19
            1   C8y C    24.3738  -18.8297
            2   C8y C    24.3738  -20.2307
            3   C8y C    25.5909  -20.9347
            4   C8y C    26.8010  -20.2307
            5   C8y C    26.8010  -18.8297
            6   C8x C    25.5909  -18.1328
            7   O1a O    23.1671  -18.1323
            8   C1a C    23.1671  -20.9352
            9   O1a O    25.5926  -22.3356
            10  C4a C    28.0156  -20.9337
            11  O4a O    28.0166  -22.3347
            12  C1c C    28.0156  -18.1338
            13  C5a C    29.2292  -18.8316
            14  C1c C    30.4440  -18.1355
            15  C1b C    31.6577  -18.8334
            16  C1a C    32.8654  -18.1373
            17  O5a O    29.2282  -20.2326
            18  C1a C    28.0166  -16.7328
            19  C1a C    30.4451  -16.7346
BOND        19
            1     3   4 2
            2     4  10 1
            3     4   5 1
            4    10  11 2
            5     5   6 2
            6     5  12 1
            7     6   1 1
            8    12  13 1
            9    13  14 1
            10    1   7 1
            11   14  15 1
            12    1   2 2
            13   15  16 1
            14    2   8 1
            15   13  17 2
            16    2   3 1
            17   12  18 1
            18    3   9 1
            19   14  19 1

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