KEGG   COMPOUND: C09319
Entry
C09319                      Compound                               

Name
Abyssinone V
Formula
C25H28O5
Exact mass
408.1937
Mol weight
408.4868
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1214 Flavanones
    C09319  Abyssinone V
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavanones
    C09319  Abyssinone V
Other DBs
CAS: 77263-11-7
PubChem: 11510
ChEBI: 2368
ChEMBL: CHEMBL255890
KNApSAcK: C00000936
3DMET: B02859
NIKKAJI: J869.483D
KCF data

ATOM        30
            1   C8y C    20.3258  -18.4260
            2   C8y C    20.3315  -17.0282
            3   C5x C    21.5372  -19.1366
            4   C8y C    19.1318  -19.1307
            5   O2x O    21.5489  -16.3350
            6   C8x C    19.1318  -16.3292
            7   C1x C    22.7545  -18.4377
            8   O5x O    21.5315  -20.5343
            9   C8x C    17.9145  -18.4260
            10  O1a O    19.1318  -20.5343
            11  C1y C    22.7602  -17.0398
            12  C8y C    17.9145  -17.0282
            13  O1a O    16.6972  -16.3292
            14  C8y C    23.9776  -16.3466
            15  C8x C    25.1832  -17.0515
            16  C8x C    23.9776  -14.9489
            17  C8y C    26.4005  -16.3583
            18  C8y C    25.1949  -14.2500
            19  C8y C    26.4064  -14.9604
            20  C1b C    27.6121  -17.0631
            21  C1b C    25.2008  -12.8521
            22  O1a O    27.6237  -14.2617
            23  C2b C    28.8235  -16.3699
            24  C2b C    26.4181  -12.1589
            25  C2c C    30.0291  -17.0689
            26  C2c C    26.4238  -10.7553
            27  C1a C    31.2464  -16.3816
            28  C1a C    30.0232  -18.4727
            29  C1a C    27.6411  -10.0564
            30  C1a C    25.2124  -10.0507
BOND        32
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 2
            9     4  10 1
            10    5  11 1
            11    6  12 2
            12   12  13 1
            13    7  11 1
            14    9  12 1
            15   11  14 1 #Down
            16   14  15 2
            17   14  16 1
            18   15  17 1
            19   16  18 2
            20   17  19 2
            21   17  20 1
            22   18  21 1
            23   19  22 1
            24   20  23 1
            25   21  24 1
            26   23  25 2
            27   24  26 2
            28   25  27 1
            29   25  28 1
            30   26  29 1
            31   26  30 1
            32   18  19 1

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