KEGG   COMPOUND: C09470Help
Entry
C09470                      Compound                               

Name
Granilin
Formula
C15H20O4
Exact mass
264.1362
Mol weight
264.3169
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Eudesmanes
    C09470  Granilin
BRITE hierarchy
Other DBs
CAS: 40737-97-1
PubChem: 11661
ChEBI: 5536
KNApSAcK: C00003296
3DMET: B02997
NIKKAJI: J16.517D
LinkDB All DBs
KCF data Show

ATOM        19
            1   C1y C    24.1974  -16.3087
            2   C1z C    24.2033  -14.9152
            3   C1x C    25.4035  -17.0185
            4   C2y C    23.0032  -17.0055
            5   C1x C    25.4151  -14.2315
            6   C1y C    23.0032  -14.2184
            7   C1a C    24.1917  -13.5217
            8   C1y C    21.7845  -16.3087
            9   C2a C    23.0032  -18.3990
            10  C1x C    21.7845  -14.9152
            11  O1a O    23.0032  -12.8249
            12  O1a O    20.5786  -17.0055
            13  C1y C    26.6152  -14.9282
            14  C1y C    26.6157  -16.3339
            15  C2y C    27.9549  -16.7619
            16  C7x C    28.7770  -15.6304
            17  O7x O    27.9540  -14.4923
            18  O6a O    30.2197  -15.6299
            19  C2a C    28.4001  -18.1293
BOND        21
            1     3  14 1
            2     4   8 1
            3     4   9 2
            4     5  13 1
            5     6  10 1
            6     6  11 1 #Up
            7     8  12 1 #Up
            8     8  10 1
            9     1   2 1
            10    1   3 1
            11    1   4 1
            12    2   5 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  13 1
            18    2   6 1
            19   16  18 2
            20    2   7 1 #Up
            21   15  19 2

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