KEGG   COMPOUND: C10394Help
Entry
C10394                      Compound                               

Name
Pseudopurpurin
Formula
C15H8O7
Exact mass
300.027
Mol weight
300.2198
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Polyketides
  Anthraquinones
   Anthraquinone type
    C10394  Pseudopurpurin
BRITE hierarchy
Other DBs
CAS: 476-41-5
PubChem: 12580
ChEBI: 8608
KNApSAcK: C00002856
3DMET: B03807
NIKKAJI: J12.549K
KCF data Show

ATOM        22
            1   C8y C    23.8524  -17.6103
            2   C8y C    23.8640  -16.2118
            3   C5x C    22.6404  -18.3153
            4   C8y C    25.0586  -18.3212
            5   C5x C    22.6521  -15.5125
            6   C8y C    25.0819  -15.5301
            7   C8y C    21.4285  -17.6043
            8   O5x O    22.6404  -19.7137
            9   C8y C    26.3464  -17.6336
            10  O1a O    25.0412  -19.7254
            11  C8y C    21.4343  -16.2001
            12  O5x O    22.6579  -14.1083
            13  C8y C    26.2881  -16.2351
            14  O1a O    25.0936  -14.1257
            15  C8x C    20.2223  -18.3095
            16  C6a C    27.4769  -18.3445
            17  C8x C    20.2223  -15.5068
            18  O1a O    27.5002  -15.5475
            19  C8x C    19.0102  -17.6043
            20  O6a O    28.6947  -17.6510
            21  O6a O    27.5293  -19.7487
            22  C8x C    19.0102  -16.2001
BOND        24
            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    6  14 1
            14    7  15 1
            15    9  16 1
            16   11  17 1
            17   13  18 1
            18   15  19 2
            19   16  20 1
            20   16  21 2
            21   17  22 2
            22    7  11 2
            23    9  13 1
            24   19  22 1

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