KEGG   COMPOUND: C14171Help
Entry
C14171                      Compound                               

Name
Orthoform;
Orthocaine
Formula
C8H9NO3
Exact mass
167.0582
Mol weight
167.162
Structure
Mol fileKCF fileDB search
Pathway
map07015  Local analgesics
Other DBs
CAS: 536-25-4
PubChem: 7846983
ChEBI: 34904
NIKKAJI: J54.519H
LinkDB All DBs
KCF data Show

ATOM        12
            1   C8y C    20.2741  -22.1877
            2   C8x C    20.2741  -23.5874
            3   C8x C    21.4863  -24.2873
            4   C8y C    22.6985  -23.5874
            5   C8x C    22.6985  -22.1877
            6   C8y C    21.4863  -21.4878
            7   C7a C    23.9120  -24.2881
            8   O7a O    25.1256  -23.5874
            9   O6a O    23.9120  -25.6871
            10  C1a C    26.3385  -24.2877
            11  O1a O    19.0618  -21.4878
            12  N1a N    21.4863  -20.0881
BOND        12
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     7   9 2
            10    8  10 1
            11    1  11 1
            12    6  12 1

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