COMPOUND: C12201
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Entry
C12201 Compound
Name
(+/-)-6-Acetonyldihydrosanguinarine;
6-Acetonyl-5,6-dihydrosanguinarine;
(+/-)-8-Acetonyldihydrosanguinarine
Formula
C23H19NO5
Exact mass
389.1263
Mol weight
389.40
Structure
Mol file
KCF file
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Other DBs
CAS:
88588-10-7 37687-34-6
PubChem:
14347
ChEBI:
31022
KNApSAcK:
C00024626
C00027777
NIKKAJI:
J585.610H
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KCF data
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ATOM 29
1 C8y C 26.9165 -17.4246
2 C8y C 25.7064 -18.1211
3 C8y C 28.1335 -18.1472
4 C8x C 26.9400 -16.0316
5 C8y C 25.6803 -19.5165
6 C8x C 24.4917 -17.4009
7 C8y C 29.4136 -17.4626
8 N1y N 28.1216 -19.5521
9 C8x C 28.1596 -15.3469
10 C1y C 26.8973 -20.2392
11 C8x C 23.2698 -18.1093
12 C8y C 29.3672 -16.0601
13 C8x C 30.5369 -18.1734
14 C1a C 29.3387 -20.2512
15 C8x C 30.5751 -15.3849
16 C8y C 31.7541 -17.4792
17 C8y C 31.7777 -16.0838
18 O2x O 33.0686 -17.9358
19 O2x O 33.1068 -15.6845
20 C1x C 33.9101 -16.8208
21 C8y C 24.4663 -20.2309
22 C8y C 23.2579 -19.5142
23 O2x O 22.2028 -20.4420
24 C1x C 22.7592 -21.7319
25 O2x O 24.1580 -21.6015
26 C1b C 26.8802 -21.6380
27 C5a C 28.0854 -22.3308
28 O5a O 29.2978 -21.6334
29 C1a C 28.0782 -23.7296
BOND 34
1 4 9 2
2 5 21 1
3 5 10 1
4 6 11 2
5 7 12 2
6 7 13 1
7 8 14 1
8 12 15 1
9 13 16 2
10 15 17 2
11 16 18 1
12 17 19 1
13 18 20 1
14 8 10 1
15 9 12 1
16 11 22 1
17 16 17 1
18 19 20 1
19 1 2 1
20 1 3 2
21 1 4 1
22 2 5 2
23 21 22 2
24 22 23 1
25 23 24 1
26 24 25 1
27 25 21 1
28 10 26 1
29 2 6 1
30 26 27 1
31 3 7 1
32 3 8 1
33 27 28 2
34 27 29 1
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