KEGG   COMPOUND: C20340
Entry
C20340                      Compound                               
Name
L-Ascorbic acid, 6-octadecanoate;
L-Ascorbic acid monostearate
Formula
C24H42O7
Exact mass
442.2931
Mol weight
442.59
Structure
Other DBs
CAS: 10605-09-1
PubChem: 163312078
ChEBI: 138822
LinkDB
KCF data

ATOM        31
            1   C1y C    27.2300  -16.5900
            2   C2y C    27.7200  -17.9200
            3   O7x O    28.3500  -15.7500
            4   C2y C    29.1200  -17.9200
            5   C7x C    29.5400  -16.5900
            6   O1a O    29.8900  -19.0400
            7   O6a O    30.5200  -15.6100
            8   C1c C    26.0400  -15.8900
            9   C1b C    24.8500  -16.5900
            10  O1a O    26.8800  -19.0400
            11  O1a O    26.0400  -14.4900
            12  O7a O    23.5900  -15.8900
            13  C7a C    22.3893  -16.6099
            14  C1b C    21.1654  -15.9300
            15  O6a O    22.4122  -17.9899
            16  C1b C    19.9326  -16.6687
            17  C1b C    18.7187  -15.9937
            18  C1b C    17.5122  -16.7168
            19  C1b C    16.2849  -16.0346
            20  C1b C    15.1046  -16.7421
            21  C1b C    13.8876  -16.0657
            22  C1b C    12.6512  -16.8062
            23  C1b C    11.4396  -16.1321
            24  C1b C    10.2315  -16.8558
            25  C1b C     9.0054  -16.1738
            26  C1b C     7.8242  -16.8814
            27  C1b C     6.6080  -16.2051
            28  C1b C     5.3708  -16.9456
            29  C1b C     4.1599  -16.2715
            30  C1b C     2.9511  -16.9952
            31  C1a C     1.7257  -16.3133
BOND        31
            1     1   2 1
            2     1   3 1
            3     2   4 2
            4     3   5 1
            5     4   6 1
            6     5   7 2
            7     4   5 1
            8     1   8 1
            9     8   9 1
            10    2  10 1
            11    8  11 1 #Down
            12    9  12 1
            13   12  13 1
            14   13  14 1
            15   13  15 2
            16   14  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   26  27 1
            28   27  28 1
            29   28  29 1
            30   29  30 1
            31   30  31 1

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