COMPOUND: C22330
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Entry
C22330 Compound
Name
3-Amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one;
AHDP
Formula
C13H18N2O2
Exact mass
234.1368
Mol weight
234.29
Structure
Mol file
KCF file
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Reaction
R12684
R12685
R12801
Enzyme
1.4.3.26
3.4.14.14
Other DBs
PubChem:
497619690
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KCF data
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ATOM 17
1 C8x C 8.6100 -13.0900
2 C8y C 8.6100 -14.4900
3 C8x C 9.8224 -15.1900
4 C8x C 11.0349 -14.4900
5 C8y C 11.0349 -13.0900
6 C8x C 9.8224 -12.3900
7 N1x N 13.4597 -14.4900
8 C1y C 13.4597 -13.0900
9 C1b C 12.2473 -12.3900
10 C5x C 14.7912 -14.9226
11 C1y C 15.6141 -13.7900
12 C1z C 14.7912 -12.6574
13 O5x O 15.3607 -16.2016
14 N1a N 17.0065 -13.9363
15 O1a O 7.3976 -15.1900
16 C1a C 15.1536 -11.3051
17 C1a C 16.1435 -12.2950
BOND 18
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 7 8 1
8 8 9 1
9 5 9 1
10 7 10 1
11 10 11 1
12 11 12 1
13 8 12 1
14 10 13 2
15 11 14 1
16 2 15 1
17 12 16 1
18 12 17 1
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