KEGG   COMPOUND: C21643
Entry
C21643                      Compound                               
Name
3-Dehydro-scyllo-inosose;
2,4-Didehydroinositol
Formula
C6H8O6
Exact mass
176.0321
Mol weight
176.12
Structure
Reaction
R11770 R11771
Pathway
map00562  Inositol phosphate metabolism
map01100  Metabolic pathways
Enzyme
1.1.1.-         3.7.1.-
Other DBs
PubChem: 346930782
LinkDB
KCF data

ATOM        12
            1   C1y C    18.5893  -17.5245
            2   C1y C    17.3738  -16.8068
            3   C5x C    19.8239  -16.8068
            4   O1a O    18.5893  -18.9272
            5   C1y C    17.3738  -15.3846
            6   O1a O    16.1518  -17.5050
            7   C1y C    19.8239  -15.3846
            8   O5x O    21.0458  -17.5050
            9   C5x C    18.5893  -14.6798
            10  O1a O    16.1583  -14.6798
            11  O1a O    21.0394  -14.6798
            12  O5x O    18.5893  -13.4181
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     3   8 2
            8     5   9 1
            9     5  10 1 #Up
            10    7  11 1 #Up
            11    9  12 2
            12    7   9 1

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