KEGG   COMPOUND: C10266Help
Entry
C10266                      Compound                               

Name
Isorhapontin
Formula
C21H24O9
Exact mass
420.142
Mol weight
420.4099
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK13 Aromatic polyketides
   PK1309 Diphenyl ethers, biphenyls, dibenzyls and stilbenes
    C10266  Isorhapontin
Phytochemical compounds [BR:br08003]
 Skimate / acetate-malonate pathway derived compounds
  Stilbenoids
   Stilbenes
    C10266  Isorhapontin
BRITE hierarchy
Other DBs
CAS: 32727-29-0
PubChem: 12452
ChEBI: 6053
ChEMBL: CHEMBL113339
LIPIDMAPS: LMPK13090010
KNApSAcK: C00002887
3DMET: B03689
NIKKAJI: J17.618D
LinkDB All DBs
KCF data Show

ATOM        30
            1   C8y C    32.0297  -17.0971
            2   C8y C    32.0881  -18.4966
            3   C8x C    30.8187  -16.3881
            4   O2a O    33.2221  -16.3824
            5   C8x C    30.8012  -19.1810
            6   O1a O    33.2164  -19.1869
            7   C8y C    29.6089  -17.0855
            8   C8x C    29.6030  -18.4849
            9   C2b C    28.4036  -16.3824
            10  C2b C    27.1994  -17.0914
            11  C8y C    26.0002  -16.3997
            12  C8x C    24.7961  -17.0914
            13  C8x C    26.0002  -15.0063
            14  C8y C    23.5850  -16.3940
            15  C8y C    24.8018  -14.3102
            16  C8x C    23.5909  -15.0006
            17  O1a O    24.7845  -12.9039
            18  O2a O    22.3668  -17.0868
            19  C1a C    34.4365  -17.0573
            20  C1y C    21.0877  -17.9472
            21  O2x O    19.8799  -17.2561
            22  C1y C    21.0877  -19.3467
            23  C1y C    18.6662  -17.9529
            24  C1y C    19.8858  -20.0552
            25  O1a O    22.3014  -20.0495
            26  C1y C    18.6721  -19.3526
            27  C1b C    17.4583  -17.2620
            28  O1a O    19.8858  -21.4489
            29  O1a O    17.4583  -20.0552
            30  O1a O    16.2446  -17.9588
BOND        32
            1    12  14 2
            2    13  15 1
            3    14  16 1
            4    15  17 1
            5     7   8 2
            6    15  16 2
            7    14  18 1
            8     1   2 1
            9     4  19 1
            10    1   3 2
            11    1   4 1
            12    2   5 2
            13    2   6 1
            14    3   7 1
            15    5   8 1
            16    7   9 1
            17    9  10 2
            18   10  11 1
            19   11  12 1
            20   11  13 2
            21   20  18 1 #Up
            22   20  21 1
            23   20  22 1
            24   21  23 1
            25   22  24 1
            26   22  25 1 #Down
            27   23  26 1
            28   23  27 1 #Up
            29   24  28 1 #Up
            30   26  29 1 #Down
            31   27  30 1
            32   24  26 1

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