KEGG   COMPOUND: C04840Help
Entry
C04840                      Compound                               

Name
3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate
Formula
C29H48O3
Exact mass
444.3603
Mol weight
444.6896
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
1.1.1.170       1.14.18.9
Other DBs
PubChem: 7398
ChEBI: 18134
LIPIDMAPS: LMST01010175
NIKKAJI: J2.755.925E
KCF data Show

ATOM        32
            1   C1z C    25.0482  -16.9552
            2   C1y C    26.2208  -16.2656
            3   C1y C    25.0482  -18.3113
            4   C1x C    23.8686  -16.2830
            5   C1a C    24.9652  -15.6179
            6   C2y C    27.4061  -16.9435
            7   C1x C    26.2791  -14.8918
            8   C1z C    23.8686  -18.9883
            9   C1x C    26.2266  -18.9824
            10  C1x C    22.7135  -16.9552
            11  C1y C    28.5902  -16.2539
            12  C2x C    27.4527  -18.3523
            13  C1x C    27.4003  -14.2093
            14  C1y C    22.7135  -18.3113
            15  C6a C    22.9077  -19.9316
            16  C1a C    24.6473  -20.6972
            17  C1z C    28.5902  -14.8801
            18  C1x C    30.9600  -16.2596
            19  O1a O    21.5456  -18.9649
            20  O6a O    21.5761  -19.9374
            21  O6a O    23.5928  -21.0935
            22  C1y C    29.7874  -14.1964
            23  C1a C    28.5494  -13.4178
            24  C1x C    30.9659  -14.8861
            25  C1c C    29.7874  -12.8589
            26  C1b C    30.9483  -12.1926
            27  C1a C    28.3367  -12.2919
            28  C1b C    32.1033  -12.8649
            29  C1b C    33.2711  -12.1986
            30  C1c C    34.4261  -12.8766
            31  C1a C    35.5939  -12.2103
            32  C1a C    34.4203  -14.2152
BOND        35
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    6  11 1
            11    6  12 2
            12    7  13 1
            13    8  14 1
            14    8  15 1 #Down
            15    8  16 1 #Up
            16   11  17 1
            17   11  18 1
            18   14  19 1 #Up
            19   15  20 1
            20   15  21 2
            21   17  22 1
            22   17  23 1 #Up
            23   18  24 1
            24   22  25 1
            25   25  26 1
            26   25  27 1 #Down
            27   26  28 1
            28   28  29 1
            29   29  30 1
            30   30  31 1
            31   30  32 1
            32    9  12 1
            33   10  14 1
            34   13  17 1
            35   22  24 1

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