KEGG   COMPOUND: C19581
Entry
C19581                      Compound                               
Name
alpha-[3-(Nitrosoamino)propyl]-3-pyridinemethanol
Formula
C9H13N3O2
Exact mass
195.1008
Mol weight
195.22
Structure
Reaction
R09432 R09436
Pathway
map00980  Metabolism of xenobiotics by cytochrome P450
map05204  Chemical carcinogenesis - DNA adducts
Network
nt06250  DNA adduct formation (cancer)
Other DBs
PubChem: 124490253
ChEBI: 82575
LinkDB
KCF data

ATOM        14
            1   N5x N    18.0600  -19.7400
            2   C8x C    18.0600  -21.1400
            3   C8x C    19.2500  -21.8400
            4   C8x C    20.5100  -21.1400
            5   C8y C    20.5100  -19.7400
            6   C8x C    19.2500  -19.0400
            7   C1c C    21.7000  -19.0400
            8   C1b C    22.9600  -19.7400
            9   C1b C    24.1500  -19.0400
            10  C1b C    25.3400  -19.7400
            11  N1b N    26.6000  -19.0400
            12  O1a O    21.7000  -17.6400
            13  N2b N    26.6000  -17.6400
            14  O3a O    27.7900  -16.9400
BOND        14
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12    7  12 1
            13   11  13 1
            14   13  14 2

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