KEGG   COMPOUND: C09158Help
Entry
C09158                      Compound                               

Name
Calophyllolide
Formula
C26H24O5
Exact mass
416.1624
Mol weight
416.4658
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1210 Neoflavonoids
    C09158  Calophyllolide
Phytochemical compounds [BR:br08003]
 Others
  Others
   Neoflavonoids
    C09158  Calophyllolide
BRITE hierarchy
Other DBs
CAS: 548-27-6
PubChem: 11350
ChEBI: 3328
LIPIDMAPS: LMPK12100001
KNApSAcK: C00002455
3DMET: B02727
NIKKAJI: J11.577K
LinkDB All DBs
KCF data Show

ATOM        31
            1   C8y C    28.9106  -16.3392
            2   C8y C    28.9048  -17.7343
            3   C8y C    27.6965  -15.6387
            4   C8y C    30.1248  -15.6445
            5   C8y C    27.6965  -18.4405
            6   O7x O    30.1131  -18.4464
            7   C8y C    26.4822  -16.3333
            8   O2x O    27.6965  -14.2377
            9   C8y C    30.1306  -14.2435
            10  C8x C    31.3332  -16.3509
            11  C8y C    26.4822  -17.7400
            12  C5a C    27.7022  -19.8415
            13  C8y C    31.3272  -17.7459
            14  C2x C    25.2681  -15.6387
            15  C1z C    26.4822  -13.5373
            16  C8x C    31.3448  -13.5489
            17  C8x C    28.9106  -13.5373
            18  O2a O    25.2741  -18.4405
            19  C2c C    26.4939  -20.5420
            20  O5a O    28.9165  -20.5303
            21  O6a O    32.5356  -18.4522
            22  C2x C    25.2681  -14.2377
            23  C1a C    25.5075  -12.4574
            24  C1a C    27.0661  -12.3172
            25  C8x C    31.3506  -12.1480
            26  C8x C    28.9222  -12.1363
            27  C1a C    24.0657  -17.7459
            28  C2b C    25.2856  -19.8474
            29  C1a C    26.4298  -21.9372
            30  C8x C    30.1365  -11.4417
            31  C1a C    24.0774  -20.5536
BOND        34
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     4  10 2
            10    5  11 2
            11    5  12 1
            12    6  13 1
            13    7  14 1
            14    8  15 1
            15    9  16 2
            16    9  17 1
            17   11  18 1
            18   12  19 1
            19   12  20 2
            20   13  21 2
            21   14  22 2
            22   15  23 1
            23   15  24 1
            24   16  25 1
            25   17  26 2
            26   18  27 1
            27   19  28 2
            28   19  29 1
            29   25  30 2
            30   28  31 1
            31    7  11 1
            32   10  13 1
            33   15  22 1
            34   26  30 1

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