KEGG   COMPOUND: C00492
Entry
C00492                      Compound                               
Name
Raffinose;
Melitose;
Melitriose;
Gossypose;
6G-alpha-D-galactosylsucrose
Formula
C18H32O16
Exact mass
504.169
Mol weight
504.4371
Structure
Remark
Same as: G00249
Reaction
Pathway
map00052  Galactose metabolism
map01100  Metabolic pathways
map02010  ABC transporters
Enzyme
2.4.1.67        2.4.1.82        2.4.1.166       3.2.1.22        
3.2.1.26
Other DBs
CAS: 512-69-6
PubChem: 3775
ChEBI: 16634 181444
KNApSAcK: C00001145
PDB-CCD: RAF[PDBj]
3DMET: B01266
NIKKAJI: J9.760H
LinkDB
KCF data

ATOM        34
            1   C1z C    30.3744  -13.8716
            2   O2a O    29.3886  -14.7933
            3   O2x O    31.5062  -13.0489
            4   C1y C    30.8062  -15.2017
            5   C1y C    28.1694  -15.5691
            6   C1y C    32.6379  -13.8716
            7   C1y C    32.2063  -15.2017
            8   O1a O    29.9894  -16.3333
            9   O2x O    26.9501  -14.8750
            10  C1y C    28.1694  -16.9692
            11  C1b C    33.9680  -13.4456
            12  O1a O    33.0229  -16.3333
            13  C1y C    25.7366  -15.5691
            14  C1y C    26.9501  -17.6751
            15  O1a O    29.3886  -17.6751
            16  O1a O    35.0006  -14.3791
            17  C1b C    24.5232  -14.8691
            18  C1y C    25.7366  -16.9692
            19  O1a O    26.9501  -19.0752
            20  O2a O    23.3099  -15.5750
            21  O1a O    24.5232  -17.5993
            22  C1y C    22.0964  -16.2809
            23  O2x O    20.8714  -15.5867
            24  C1y C    22.0964  -17.6810
            25  C1y C    19.6578  -16.2809
            26  C1y C    20.8714  -18.3868
            27  O1a O    23.3099  -18.4568
            28  C1y C    19.6578  -17.6810
            29  C1b C    18.4678  -15.5867
            30  O1a O    20.8714  -19.7869
            31  O1a O    18.4678  -18.3868
            32  O1a O    17.3885  -16.4908
            33  C1b C    29.3845  -12.8816
            34  O1a O    28.0471  -13.2400
BOND        36
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     5   2 1 #Down
            5     3   6 1
            6     4   7 1
            7     4   8 1 #Down
            8     5   9 1
            9     5  10 1
            10    6  11 1 #Down
            11    7  12 1 #Up
            12    9  13 1
            13   10  14 1
            14   10  15 1 #Down
            15   11  16 1
            16   13  17 1 #Up
            17   13  18 1
            18   14  19 1 #Up
            19   17  20 1
            20   18  21 1 #Down
            21   22  20 1 #Down
            22   22  23 1
            23   22  24 1
            24   23  25 1
            25   24  26 1
            26   24  27 1 #Down
            27   25  28 1
            28   25  29 1 #Up
            29   26  30 1 #Up
            30   28  31 1 #Up
            31   29  32 1
            32    6   7 1
            33   14  18 1
            34   26  28 1
            35    1  33 1 #Up
            36   33  34 1

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