KEGG   COMPOUND: C09515
Entry
C09515                      Compound                               
Name
Multiradiatin
Formula
C20H22O6
Exact mass
358.1416
Mol weight
358.3851
Structure
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Pseudoguaianolide
    C09515  Multiradiatin
Other DBs
CAS: 58262-52-5
PubChem: 11706
ChEBI: 7023
KNApSAcK: C00003336
3DMET: B03038
NIKKAJI: J2.770.070E
LinkDB
KCF data

ATOM        26
            1   C1y C    24.6421  -15.7206
            2   C1y C    25.8599  -15.0258
            3   C1z C    23.3306  -15.2087
            4   O7a O    24.6388  -17.1144
            5   C1y C    26.0615  -13.6240
            6   C2y C    27.1259  -15.6488
            7   C1y C    22.9146  -13.8716
            8   C5x C    22.1897  -16.0135
            9   C1a C    23.3329  -16.6027
            10  C7a C    25.3505  -18.3145
            11  C5x C    25.1064  -12.5957
            12  O7x O    27.4530  -13.3827
            13  C7x C    28.1128  -14.6357
            14  C2a C    27.3671  -17.0227
            15  C1y C    23.7077  -12.7090
            16  C2x C    21.5206  -13.8565
            17  C2x C    21.0674  -15.1735
            18  O5x O    22.1630  -17.4077
            19  C2b C    24.6746  -19.5227
            20  O6a O    26.7443  -18.3647
            21  O5x O    25.6123  -11.2957
            22  O6a O    29.4913  -14.8316
            23  C1a C    22.9840  -11.5030
            24  C2c C    25.3809  -20.7229
            25  C1a C    24.7050  -21.9369
            26  C1a C    26.7761  -20.7063
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     3   9 1 #Up
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    6  14 2
            14    7  15 1
            15    7  16 1
            16    8  17 1
            17    8  18 2
            18   10  19 1
            19   10  20 2
            20   11  21 2
            21   13  22 2
            22   15  23 1 #Down
            23   19  24 2
            24   24  25 1
            25   11  15 1
            26   12  13 1
            27   16  17 2
            28   24  26 1

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