KEGG   COMPOUND: C11106
Entry
C11106                      Compound                               

Name
3-Oxobutanamide;
Acetoacetamide;
AAA
Formula
C4H7NO2
Exact mass
101.0477
Mol weight
101.1039
Structure
Other DBs
CAS: 5977-14-0
PubChem: 13288
ChEBI: 28515
ChEMBL: CHEMBL1984636
NIKKAJI: J26.750C
KCF data

ATOM        7
            1   C1a C    25.6200  -20.5800
            2   C5a C    26.8800  -19.8800
            3   C1b C    28.0700  -20.5800
            4   C5a C    29.2600  -19.8800
            5   N1a N    30.4500  -20.5800
            6   O5a O    26.8800  -18.4800
            7   O5a O    29.2600  -18.4800
BOND        6
            1     3   4 1
            2     4   5 1
            3     2   3 1
            4     2   6 2
            5     1   2 1
            6     4   7 2

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