COMPOUND: C16605
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Entry
C16605 Compound
Name
2H-Dibenz[b,f]azepin-2-one
Formula
C14H9NO
Exact mass
207.0684
Mol weight
207.2274
Structure
Mol file
KCF file
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Reaction
R08319
Pathway
map00982
Drug metabolism - cytochrome P450
Other DBs
PubChem:
51090931
ChEBI:
80600
NIKKAJI:
J83.067D
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KCF data
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ATOM 16
1 C2y C 24.3046 -19.4780
2 N2x N 25.5602 -18.8622
3 C8y C 26.8325 -19.4539
4 C8y C 27.1590 -20.8079
5 C2y C 24.0088 -20.8583
6 C2x C 26.3044 -21.9230
7 C2x C 24.9005 -21.9415
8 C2x C 23.2639 -18.5378
9 C2x C 21.9293 -18.9690
10 C5x C 21.6335 -20.3493
11 C2x C 22.6742 -21.2894
12 C8x C 28.5139 -21.1709
13 C8x C 29.5056 -20.1791
14 C8x C 29.1426 -18.8242
15 C8x C 27.7878 -18.4613
16 O5x O 20.3276 -20.7709
BOND 18
1 3 4 1
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 2
7 6 7 2
8 1 8 1
9 8 9 2
10 9 10 1
11 10 11 1
12 5 11 2
13 4 12 2
14 12 13 1
15 13 14 2
16 14 15 1
17 15 3 2
18 10 16 2
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