COMPOUND: C21776
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Entry
C21776 Compound
Name
2-({[(4-Methoxyphenyl)methyl](methyl)amino}methyl)-2-methylpropane-1,3-diol
Formula
C14H23NO3
Exact mass
253.1678
Mol weight
253.3373
Structure
Mol file
KCF file
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Reaction
R11930
Enzyme
3.3.2.9
Other DBs
PubChem:
354339119
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KCF data
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ATOM 18
1 C1b C 11.7102 -18.4986
2 C8y C 10.5189 -17.7978
3 C8x C 10.5189 -16.3962
4 C8x C 9.3275 -15.6954
5 C8y C 8.0661 -16.3962
6 C8x C 8.0661 -17.7978
7 C8x C 9.2575 -18.4986
8 O2a O 6.8748 -15.6954
9 C1a C 5.6835 -16.3962
10 N1c N 12.9207 -17.8126
11 C1a C 12.9207 -16.4126
12 C1b C 14.1331 -18.5126
13 C1d C 15.3648 -17.8019
14 C1b C 16.5415 -18.4816
15 O1a O 17.7386 -17.7907
16 C1b C 15.2957 -16.3805
17 O1a O 16.6043 -15.6660
18 C1a C 15.3648 -19.2019
BOND 18
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 6 7 2
7 2 7 1
8 5 8 1
9 8 9 1
10 1 10 1
11 10 11 1
12 10 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 13 16 1
17 16 17 1
18 13 18 1
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