COMPOUND: C20519
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Entry
C20519 Compound
Name
Cyclo(L-leucyl-L-phenylalanyl);
(3S,6S)-3-Benzyl-6-(2-methylpropyl)piperazine-2,5-dione
Formula
C15H20N2O2
Exact mass
260.1525
Mol weight
260.33
Structure
Mol file
KCF file
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Reaction
R10327
R10329
R10334
Enzyme
1.3.3.13
2.3.2.20
Other DBs
CAS:
7280-77-5
PubChem:
172232268
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KCF data
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ATOM 19
1 C1y C 17.4054 -15.5184
2 N1x N 17.4054 -16.9321
3 C5x C 18.6298 -17.6390
4 C1y C 19.8542 -16.9321
5 N1x N 19.8542 -15.5184
6 C5x C 18.6298 -14.8115
7 O5x O 18.6298 -13.3978
8 O5x O 18.6298 -19.0529
9 C1b C 16.2159 -14.8314
10 C1b C 21.0503 -17.6230
11 C8y C 15.0235 -15.5197
12 C1c C 22.2418 -16.9351
13 C1a C 23.4379 -17.6259
14 C1a C 22.2421 -15.5252
15 C8x C 13.8397 -14.8363
16 C8x C 12.6273 -15.5362
17 C8x C 12.6273 -16.9362
18 C8x C 13.8110 -17.6197
19 C8x C 15.0234 -16.9197
BOND 20
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 6 7 2
8 3 8 2
9 1 9 1 #Up
10 4 10 1 #Up
11 9 11 1
12 10 12 1
13 12 13 1
14 12 14 1
15 11 15 2
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 11 19 1
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