KEGG   COMPOUND: C10401Help
Entry
C10401                      Compound                               

Name
Rhein
Formula
C15H8O6
Exact mass
284.0321
Mol weight
284.2204
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK13 Aromatic polyketides
   PK1304 Anthracenes and phenanthrenes
    C10401  Rhein
Phytochemical compounds [BR:br08003]
 Polyketides
  Anthraquinones
   Anthraquinone type
    C10401  Rhein
BRITE hierarchy
Other DBs
CAS: 
478-43-3
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        21
            1   C8y C    24.9721  -31.9497
            2   C8y C    25.0247  -33.3485
            3   C5x C    23.7599  -31.2505
            4   C8y C    26.1902  -31.2679
            5   C5x C    23.7482  -34.0538
            6   C8x C    26.1611  -34.0595
            7   C8y C    22.5418  -31.9382
            8   O5x O    23.6956  -29.8458
            9   C8x C    27.3907  -31.9730
            10  O1a O    26.2018  -29.8633
            11  C8y C    22.5359  -33.3427
            12  O5x O    23.7423  -35.4526
            13  C8y C    27.3792  -33.3718
            14  C8y C    21.3294  -31.2445
            15  C8x C    21.3294  -34.0479
            16  C6a C    28.5797  -34.0654
            17  C8x C    20.1113  -31.9382
            18  O1a O    21.3294  -29.8400
            19  C8x C    20.1113  -33.3427
            20  O6a O    29.7862  -33.3601
            21  O6a O    28.5797  -35.4700
BOND        23
            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    5  12 2
            12    6  13 2
            13    7  14 1
            14   11  15 1
            15   13  16 1
            16   14  17 2
            17   14  18 1
            18   15  19 2
            19   16  20 1
            20   16  21 2
            21    7  11 2
            22    9  13 1
            23   17  19 1

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