COMPOUND: C08477
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Entry
C08477 Compound
Name
Dianthalexin;
7-Hydroxy-2-phenyl-4H-3,1-benzoxazin-4-one
Formula
C14H9NO3
Exact mass
239.0582
Mol weight
239.2262
Structure
Mol file
KCF file
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Other DBs
CAS:
85915-62-4
PubChem:
10670
ChEBI:
4491
KNApSAcK:
C00001536
NIKKAJI:
J454.224J
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KCF data
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ATOM 18
1 C8y C 26.7949 -19.8799
2 C8y C 26.8007 -18.4763
3 N5x N 28.0062 -20.5845
4 C8x C 25.5951 -20.5845
5 C8y C 28.0179 -17.7890
6 C8x C 25.5951 -17.7833
7 C8y C 29.2234 -19.8857
8 C8y C 24.3838 -19.8799
9 O7x O 29.1593 -18.4879
10 O6a O 28.0062 -16.3798
11 C8x C 24.3838 -18.4763
12 C8y C 30.4290 -20.5962
13 O1a O 23.1666 -20.5729
14 C8x C 30.4233 -21.9940
15 C8x C 31.6462 -19.8973
16 C8x C 31.6346 -22.6986
17 C8x C 32.8575 -20.6079
18 C8x C 32.8518 -22.0056
BOND 20
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 2
8 5 9 1
9 5 10 2
10 6 11 2
11 7 12 1
12 8 13 1
13 12 14 2
14 12 15 1
15 14 16 1
16 15 17 2
17 16 18 2
18 7 9 1
19 8 11 1
20 17 18 1
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