COMPOUND: C12199
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Entry
C12199 Compound
Name
3-Methoxy-8,9-methylenedioxy-3,4-dihydrophenanthridine;
3-Methoxy-3,4-dihydro-[1,3]-dioxolo-[4,5-j]-phenanthridine
Formula
C15H13NO3
Exact mass
255.0895
Mol weight
255.2686
Structure
Mol file
KCF file
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Other DBs
PubChem:
14345
ChEBI:
31117
NIKKAJI:
J2.781.426C
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KCF data
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ATOM 19
1 C8x C 26.0854 -22.0020
2 C8x C 26.0854 -19.1995
3 C8y C 27.2947 -19.9001
4 C8y C 27.2888 -21.3014
5 C8x C 28.4993 -22.0071
6 N5x N 29.7157 -21.3117
7 C8y C 24.8689 -21.3014
8 C8y C 24.8657 -19.8996
9 O2x O 23.5315 -19.4696
10 C1x C 22.7105 -20.6055
11 O2x O 23.5370 -21.7377
12 C8y C 28.5113 -19.2048
13 C8y C 29.7159 -19.9134
14 C1x C 30.9318 -19.2245
15 C1y C 30.9434 -17.8270
16 C2x C 29.7388 -17.1184
17 C2x C 28.5227 -17.8071
18 O2a O 32.1626 -17.1364
19 C1a C 33.3704 -17.8468
BOND 22
1 1 4 1
2 3 2 1
3 7 8 1
4 8 9 1
5 9 10 1
6 10 11 1
7 11 7 1
8 3 4 2
9 4 5 1
10 5 6 2
11 6 13 1
12 12 3 1
13 2 8 2
14 12 13 2
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 2
19 17 12 1
20 15 18 1
21 7 1 2
22 18 19 1
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