KEGG   COMPOUND: C08760
Entry
C08760                      Compound                               
Name
Glaucarubin
Formula
C25H36O10
Exact mass
496.2308
Mol weight
496.5473
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Triterpenoids (C30)
   Dammarenes
    C08760  Glaucarubin
Other DBs
CAS: 1448-23-3
PubChem: 10953
ChEBI: 5370
KNApSAcK: C00003710
3DMET: B02385
NIKKAJI: J34.246G
LinkDB
KCF data

ATOM        35
            1   C1z C    24.1719  -15.9961
            2   C1y C    22.9495  -15.2765
            3   C1y C    25.4177  -15.2942
            4   C1y C    24.1660  -17.4174
            5   C1x C    24.5813  -14.9723
            6   C1z C    21.7093  -15.9844
            7   C1z C    22.9612  -13.8495
            8   C1y C    26.6461  -16.0135
            9   C1y C    25.4294  -13.8729
            10  C1x C    22.9378  -18.1369
            11  O7x O    25.4002  -18.1486
            12  O2x O    24.1361  -14.1123
            13  C1y C    21.7036  -17.4116
            14  C1y C    20.4811  -15.2707
            15  C1a C    21.6976  -14.5571
            16  C1y C    24.1954  -13.1475
            17  O1a O    21.7853  -12.7858
            18  C7x C    26.7044  -17.4467
            19  O7a O    27.8803  -15.2882
            20  C1a C    26.6695  -13.1650
            21  C2y C    20.4811  -18.1310
            22  C1y C    19.2352  -15.9844
            23  O1a O    20.4811  -13.8435
            24  O1a O    24.2069  -11.7203
            25  O6a O    27.8686  -18.1719
            26  C7a C    29.1145  -15.9901
            27  C2x C    19.2352  -17.4116
            28  C1a C    20.4811  -19.5582
            29  O1a O    17.9952  -15.2707
            30  C1d C    30.3485  -15.2707
            31  O6a O    29.1260  -17.4174
            32  C1b C    31.5827  -15.9667
            33  C1a C    31.0504  -14.0308
            34  O1a O    29.6234  -14.0308
            35  C1a C    32.8112  -15.2473
BOND        39
            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    4  11 1
            11    5  12 1
            12    6  13 1
            13    6  14 1
            14    6  15 1 #Up
            15    7  16 1
            16    7  17 1
            17    8  18 1
            18    8  19 1 #Up
            19    9  20 1 #Down
            20   13  21 1
            21   14  22 1
            22   14  23 1 #Up
            23   16  24 1 #Down
            24   18  25 2
            25   19  26 1
            26   21  27 2
            27   21  28 1
            28   22  29 1 #Down
            29   26  30 1
            30   26  31 2
            31   30  32 1
            32   30  33 1 #Down
            33   30  34 1 #Up
            34   32  35 1
            35    7  12 1 #Up
            36    9  16 1
            37   10  13 1
            38   11  18 1
            39   22  27 1

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