COMPOUND: C12224
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Entry
C12224 Compound
Name
N-Methyl-2,3,7,8-tetramethoxybenzophenanthridine-6(5H)-one
Formula
C22H21NO5
Exact mass
379.142
Mol weight
379.4058
Structure
Mol file
KCF file
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Other DBs
PubChem:
14369
ChEBI:
31884
NIKKAJI:
J2.781.609F
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KCF data
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ATOM 28
1 C8x C 27.4166 -16.7578
2 C8x C 28.6322 -16.0577
3 C8y C 29.8406 -16.7578
4 C8y C 29.8347 -18.1581
5 C8x C 31.0443 -18.8633
6 C8x C 31.0564 -16.0630
7 C8y C 32.2660 -16.7682
8 C8y C 32.2533 -18.1647
9 C8y C 28.6322 -18.8582
10 C8y C 27.4166 -18.1581
11 C8y C 27.4197 -20.9636
12 N4y N 28.6337 -20.2610
13 C8y C 26.2041 -20.2635
14 C8y C 26.2051 -18.8635
15 C8x C 24.9931 -18.1627
16 C8x C 23.7802 -18.8618
17 C8y C 23.7792 -20.2617
18 C8y C 24.9910 -20.9626
19 O2a O 33.4833 -16.0762
20 O2a O 33.4629 -18.8701
21 C1a C 34.6912 -16.7843
22 C1a C 34.6785 -18.1754
23 C1a C 29.8471 -20.9597
24 O2a O 24.9900 -22.3629
25 C1a C 23.7768 -23.0620
26 O2a O 22.5660 -20.9609
27 C1a C 21.3538 -20.2598
28 O5x O 27.4210 -22.3639
BOND 31
1 4 5 1
2 5 8 2
3 7 6 2
4 6 3 1
5 2 1 1
6 13 14 2
7 14 15 1
8 15 16 2
9 16 17 1
10 17 18 2
11 18 13 1
12 7 8 1
13 7 19 1
14 1 10 2
15 8 20 1
16 9 4 2
17 19 21 1
18 3 2 2
19 20 22 1
20 3 4 1
21 12 23 1
22 9 10 1
23 18 24 1
24 10 14 1
25 24 25 1
26 13 11 1
27 17 26 1
28 11 12 1
29 26 27 1
30 12 9 1
31 11 28 2
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