KEGG   COMPOUND: C06661Help
Entry
C06661                      Compound                               

Name
Clavulanate-9-aldehyde
Formula
C8H7NO5
Exact mass
197.0324
Mol weight
197.1449
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00331  Clavulanic acid biosynthesis
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Other DBs
PubChem: 8886
ChEBI: 27819
3DMET: B02084
NIKKAJI: J1.018.184D J2.373.851A
LinkDB All DBs
KCF data Show

ATOM        14
            1   N1y N    35.7420  -22.7776
            2   C1y C    37.0743  -23.1983
            3   C1y C    35.7420  -21.3751
            4   C5x C    34.3395  -22.7776
            5   C2y C    37.9157  -22.0763
            6   C6a C    37.0743  -24.6007
            7   O2x O    37.0743  -20.9544
            8   C1x C    34.3395  -21.3751
            9   C2b C    39.3182  -22.0763
            10  O6a O    36.0926  -25.5824
            11  O6a O    38.0560  -25.5824
            12  O5x O    33.3479  -23.7692
            13  C4a C    40.0194  -20.8618
            14  O4a O    41.4216  -20.8618
BOND        15
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1 #Up
            7     3   8 1
            8     5   9 2
            9     6  10 1
            10    6  11 2
            11    4   8 1
            12    5   7 1
            13    4  12 2
            14    9  13 1
            15   13  14 2

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