KEGG   COMPOUND: C04287Help
Entry
C04287                      Compound                               

Name
3D-3,5/4-Trihydroxycyclohexane-1,2-dione;
D-2,3-Diketo-4-deoxy-epi-inositol;
(3R,4S,5R)-3,4,5-Trihydroxy-1,2-cyclohexanedione;
3,5/4-Trihydroxycyclohexa-1,2-dione
Formula
C6H8O5
Exact mass
160.0372
Mol weight
160.1247
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00562  Inositol phosphate metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Enzyme
3.7.1.22        4.2.1.44
Other DBs
CAS: 949461-91-0
PubChem: 6949
ChEBI: 16145 28446
3DMET: B01730
NIKKAJI: J2.749.622I
LinkDB All DBs
KCF data Show

ATOM        11
            1   C1y C    25.9700  -22.0500
            2   C1y C    27.1600  -22.7500
            3   C5x C    25.9700  -20.6500
            4   O1a O    24.7100  -22.7500
            5   C1y C    28.3500  -22.0500
            6   O1a O    27.1600  -24.1500
            7   C5x C    27.1600  -19.9500
            8   O5x O    24.7100  -19.9500
            9   C1x C    28.3500  -20.6500
            10  O1a O    29.6100  -22.7500
            11  O5x O    27.1600  -18.5500
BOND        11
            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 2
            11    7   9 1

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