KEGG   COMPOUND: C21087Help
Entry
C21087                      Compound                               

Name
3-[(1R,2S,5R,6S)-5-Hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]-2-oxopropanoate;
Epoxy-4S-H4HPP
Formula
C9H12O5
Exact mass
200.0685
Mol weight
200.1886
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00998  Biosynthesis of secondary metabolites - other antibiotics
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00787  Bacilysin biosynthesis, prephenate => bacilysin
Other DBs
PubChem: 310920468
LinkDB All DBs
KCF data Show

ATOM        14
            1   C1y C    17.9903  -14.0703
            2   C1y C    17.9903  -15.4703
            3   C1y C    19.2027  -16.1703
            4   C1x C    20.4152  -15.4703
            5   C1x C    20.4152  -14.0703
            6   C1y C    19.2027  -13.3703
            7   O1a O    19.2027  -11.9705
            8   O2x O    16.7778  -14.7703
            9   C1b C    19.2027  -17.5702
            10  C5a C    17.9735  -18.2801
            11  O5a O    16.7694  -17.5850
            12  C6a C    17.9737  -19.6703
            13  O6a O    19.1987  -20.3774
            14  O6a O    16.7737  -20.3634
BOND        15
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     6   7 1 #Down
            8     1   8 1 #Up
            9     2   8 1 #Up
            10    3   9 1 #Up
            11    9  10 1
            12   10  11 2
            13   10  12 1
            14   12  13 2
            15   12  14 1

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