KEGG   COMPOUND: C08787
Entry
C08787                      Compound                               
Name
Undulatone
Formula
C27H34O11
Exact mass
534.2101
Mol weight
534.5523
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Triterpenoids (C30)
   Dammarenes
    C08787  Undulatone
Other DBs
CAS: 70993-77-0
PubChem: 10980
ChEBI: 9876
KNApSAcK: C00003735
3DMET: B02409
NIKKAJI: J20.169C
LinkDB
KCF data

ATOM        38
            1   C1z C    25.4339  -13.8695
            2   C1y C    24.1996  -13.1441
            3   C1y C    25.4222  -15.2911
            4   C1y C    26.6682  -13.1675
            5   C1x C    25.9077  -12.8337
            6   C1z C    22.9655  -13.8520
            7   C1z C    24.2113  -11.7227
            8   C1y C    24.1879  -15.9988
            9   O7x O    26.6508  -16.0105
            10  C1y C    27.9026  -13.8871
            11  C1y C    26.6799  -11.7402
            12  O2x O    25.4625  -11.9038
            13  C1y C    22.9595  -15.2794
            14  C1y C    21.7252  -13.1383
            15  C1a C    22.9538  -12.5647
            16  C1y C    25.4516  -11.0207
            17  O1a O    22.9070  -10.5312
            18  O7a O    24.1764  -17.4262
            19  C7x C    27.9608  -15.3086
            20  O7a O    29.1426  -13.1852
            21  C1a C    27.9260  -11.0384
            22  C2y C    21.7252  -15.9988
            23  C5x C    20.4909  -13.8520
            24  O1a O    21.7312  -11.7110
            25  O1a O    25.4456   -9.5759
            26  C7a C    25.3871  -18.1339
            27  O6a O    29.1192  -16.0339
            28  C7a C    30.3712  -13.8988
            29  C2x C    20.4909  -15.2794
            30  C1a C    21.7312  -17.4262
            31  O5x O    19.2509  -13.1383
            32  C2c C    25.3754  -19.5379
            33  O6a O    26.6039  -17.4437
            34  C1a C    31.6112  -13.1909
            35  O6a O    30.3652  -15.3260
            36  C2b C    26.5805  -20.2456
            37  C1a C    24.1530  -20.2282
            38  C1a C    26.5688  -21.6438
BOND        42
            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 #Down
            18    9  19 1
            19   10  20 1 #Up
            20   11  21 1 #Down
            21   13  22 1
            22   14  23 1
            23   14  24 1 #Up
            24   16  25 1 #Down
            25   18  26 1
            26   19  27 2
            27   20  28 1
            28   22  29 2
            29   22  30 1
            30   23  31 2
            31   26  32 1
            32   26  33 2
            33   28  34 1
            34   28  35 2
            35   32  36 2
            36   32  37 1
            37   36  38 1
            38    7  12 1 #Up
            39    8  13 1
            40   10  19 1
            41   11  16 1
            42   23  29 1

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