KEGG   COMPOUND: C08582Help
Entry
C08582                      Compound                               

Name
Bixin;
Methyl (9-cis)-hydrogen-6,6'-diapo-psi,psi-carotenedioate
Formula
C25H30O4
Exact mass
394.2144
Mol weight
394.5033
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0107 C40 isoprenoids (tetraterpenes)
    C08582  Bixin
Phytochemical compounds [BR:br08003]
 Terpenoids
  Carotenoids and apocarotenoids
   Apocarotenoids
    C08582  Bixin
BRITE hierarchy
Other DBs
CAS: 6983-79-5
PubChem: 10775
ChEBI: 3136
ChEMBL: CHEMBL1172615
KNApSAcK: C00003762
3DMET: B02240
NIKKAJI: J9.821C
LinkDB All DBs
KCF data Show

ATOM        29
            1   C2c C    32.2427  -13.4292
            2   C2b C    32.2427  -14.8313
            3   C2b C    31.0313  -12.7284
            4   C1a C    33.4610  -12.7284
            5   C2b C    33.4610  -15.5254
            6   C2b C    29.8199  -13.4292
            7   C7a C    33.4610  -16.9205
            8   C2b C    28.6085  -12.7284
            9   O7a O    34.6724  -17.6146
            10  O6a O    32.2427  -17.6216
            11  C2c C    27.3973  -13.4292
            12  C1a C    35.8769  -16.9138
            13  C2b C    26.1790  -12.7284
            14  C1a C    27.3973  -14.8313
            15  C2b C    24.9812  -13.4292
            16  C2b C    23.7631  -12.7284
            17  C2b C    22.5517  -13.4292
            18  C2c C    21.3334  -12.7284
            19  C2b C    20.1289  -13.4292
            20  C1a C    21.3334  -11.3264
            21  C2b C    18.9106  -12.7284
            22  C2b C    17.6994  -13.4292
            23  C2c C    16.4811  -12.7284
            24  C2b C    15.2833  -13.4292
            25  C1a C    16.4811  -11.3264
            26  C2b C    14.0719  -12.7284
            27  C6a C    12.8538  -13.4292
            28  O6a O    12.8538  -14.8313
            29  O6a O    11.6491  -12.7284
BOND        28
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     5   7 1
            7     6   8 2
            8     7   9 1
            9     7  10 2
            10    8  11 1
            11    9  12 1
            12   11  13 2
            13   11  14 1
            14   13  15 1
            15   15  16 2
            16   16  17 1
            17   17  18 2
            18   18  19 1
            19   18  20 1
            20   19  21 2
            21   21  22 1
            22   22  23 2
            23   23  24 1
            24   23  25 1
            25   24  26 2
            26   26  27 1
            27   27  28 1
            28   27  29 2

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