KEGG   COMPOUND: C19867Help
Entry
C19867                      Compound                               

Name
beta-D-Glucosyl crocetin
Formula
C26H34O9
Exact mass
490.2203
Mol weight
490.5428
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00999  Biosynthesis of secondary metabolites - unclassified
map01110  Biosynthesis of secondary metabolites
Enzyme
2.4.1.271       2.4.1.330
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Carotenoids and apocarotenoids
   Apocarotenoids
    C19867  beta-D-Glucosyl crocetin
BRITE hierarchy
Other DBs
PubChem: 135626334
KNApSAcK: C00023155
KCF data Show

ATOM        35
            1   C2b C    33.1608  -28.7813
            2   C2c C    34.3443  -29.4775
            3   C2b C    31.9774  -29.4775
            4   C6a C    35.5975  -28.7813
            5   C1a C    34.3443  -30.8699
            6   C2b C    30.7939  -28.7813
            7   O6a O    35.5975  -27.3889
            8   O6a O    36.7810  -29.4775
            9   C2c C    29.5407  -29.4775
            10  C2b C    28.3572  -28.7813
            11  C1a C    29.5407  -30.8699
            12  C2b C    27.1737  -29.4775
            13  C2b C    25.9206  -28.7813
            14  C2b C    24.7370  -29.4775
            15  C2c C    23.5535  -28.7813
            16  C2b C    22.3004  -29.4775
            17  C1a C    23.5535  -27.3889
            18  C2b C    21.1168  -28.7813
            19  C2b C    19.9334  -29.4775
            20  C2c C    18.7499  -28.7813
            21  C7a C    17.4968  -29.4775
            22  C1a C    18.7499  -27.3889
            23  O7a O    17.4968  -30.8699
            24  O6a O    16.3132  -28.7813
            25  C1y C    16.2910  -31.5661
            26  O2x O    15.1020  -30.8794
            27  C1y C    13.8961  -31.5755
            28  C1y C    13.8959  -32.9679
            29  C1y C    15.0849  -33.6545
            30  C1y C    16.2908  -32.9584
            31  O1a O    15.0847  -35.0467
            32  C1b C    12.6716  -30.8684
            33  O1a O    11.3420  -31.6948
            34  O1a O    12.6797  -33.6699
            35  O1a O    17.5133  -33.6645
BOND        35
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 2
            7     4   8 1
            8     6   9 1
            9     9  10 2
            10    9  11 1
            11   10  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   15  16 1
            16   15  17 1
            17   16  18 2
            18   18  19 1
            19   19  20 2
            20   20  21 1
            21   20  22 1
            22   21  23 1
            23   21  24 2
            24   25  23 1 #Up
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   25  30 1
            31   29  31 1 #Up
            32   27  32 1 #Up
            33   32  33 1
            34   28  34 1 #Down
            35   30  35 1 #Down

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