COMPOUND: C07495
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Entry
C07495 Compound
Name
Dihydroxycarbazepine;
10,11-Dihydro-10,11-dihydroxy-5H-dibenzazepine-5-carboxamide;
10,11-Dihydroxycarbamazepine
Formula
C15H14N2O3
Exact mass
270.1004
Mol weight
270.2833
Structure
Mol file
KCF file
DB search
Reaction
R08314
R08322
Pathway
map00982
Drug metabolism - cytochrome P450
Enzyme
3.3.2.-
Other DBs
CAS:
35079-97-1
PubChem:
9698
ChEBI:
4592
NIKKAJI:
J372.992C
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KCF data
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ATOM 20
1 C8y C 19.9731 -15.8379
2 N1y N 21.2131 -15.1967
3 C8y C 22.4951 -15.7602
4 C8y C 22.8497 -17.1045
5 C8y C 19.7071 -17.2216
6 C1y C 22.0203 -18.2356
7 C1y C 20.6198 -18.2837
8 C8x C 24.2006 -17.4721
9 C8x C 25.1944 -16.4860
10 C8x C 24.8398 -15.1418
11 C8x C 23.4890 -14.7741
12 C8x C 18.9145 -14.9217
13 C8x C 17.5918 -15.3803
14 C8x C 17.3258 -16.7639
15 C8x C 18.3844 -17.6802
16 O1a O 20.0678 -19.5432
17 O1a O 22.6949 -19.5126
18 C5a C 21.2131 -13.7967
19 O5a O 22.4261 -13.0964
20 N1a N 19.9954 -13.0937
BOND 22
1 3 4 1
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 4 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 3 11 2
13 1 12 2
14 12 13 1
15 13 14 2
16 14 15 1
17 5 15 2
18 7 16 1
19 6 17 1
20 2 18 1
21 18 19 2
22 18 20 1
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