COMPOUND: C22803
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Entry
C22803 Compound
Name
5F-MDMB-PICA;
Methyl (2S)-2-[1-(5-fluoropentyl)-1H-indole-3-carboxamido]-3,3-dimethylbutanoate
Formula
C21H29FN2O3
Exact mass
376.2162
Mol weight
376.465
Structure
Mol file
KCF file
DB search
Brite
Narcotics and psychotropics in Japan [
br08308.html
]
Narcotics by Cabinet Order Article 1 (157 substances)
C22803
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Other DBs
CAS:
1971007-88-1
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KCF data
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ATOM 27
1 C1c C 20.1645 -12.6028
2 O7a O 19.9544 -10.2222
3 C7a C 19.3943 -11.4825
4 O6a O 17.9239 -11.4825
5 C1d C 21.5648 -12.6028
6 C1a C 22.2650 -13.7931
7 C1a C 22.2650 -11.3425
8 C1a C 22.9650 -12.6028
9 C8x C 13.8631 -15.6835
10 C8x C 13.8631 -17.0837
11 C8x C 14.9833 -17.7839
12 C8y C 16.2435 -17.0837
13 C8y C 16.2435 -15.6835
14 C8x C 14.9833 -14.9833
15 N4y N 17.5739 -17.5038
16 C8x C 18.5115 -16.3713
17 C8y C 17.5739 -15.2634
18 C1b C 18.1340 -18.8342
19 N1b N 19.5343 -13.9331
20 C5a C 18.1340 -14.0731
21 O5a O 17.2938 -12.9529
22 C1b C 20.1645 -20.2345
23 C1b C 19.6043 -18.9742
24 C1b C 22.0549 -21.6348
25 C1b C 21.4948 -20.3745
26 X F 23.3851 -21.7749
27 C1a C 18.9644 -9.2323
BOND 28
1 2 3 1
2 1 3 1
3 3 4 2
4 1 5 1
5 5 6 1
6 5 7 1
7 5 8 1
8 9 10 2
9 10 11 1
10 11 12 2
11 12 13 1
12 13 14 2
13 9 14 1
14 12 15 1
15 16 17 2
16 13 17 1
17 15 18 1
18 19 20 1
19 17 20 1
20 20 21 2
21 15 16 1
22 22 23 1
23 18 23 1
24 24 25 1
25 22 25 1
26 24 26 1
27 1 19 1 #Down
28 2 27 1
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