COMPOUND: C20712
Help
Entry
C20712 Compound
Name
(S)-Laudanine;
(+)-Laudanidine;
5-[((1S)-6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-methoxyphenol
Formula
C20H25NO4
Exact mass
343.1784
Mol weight
343.42
Structure
Mol file
KCF file
DB search
Reaction
R10605
Enzyme
2.1.1.291
Other DBs
CAS:
3122-95-0
PubChem:
254741181
LinkDB
All DBs
KCF data
Show
ATOM 25
1 C8y C 19.2464 -19.6711
2 C8y C 19.2464 -18.2759
3 C8x C 17.9906 -17.5783
4 C8y C 16.8047 -18.2759
5 C8y C 16.8047 -19.6711
6 C8x C 17.9906 -20.3687
7 C1x C 20.4323 -20.3687
8 C1x C 21.6182 -19.6711
9 N1y N 21.6182 -18.2759
10 C1y C 20.4323 -17.5783
11 C1b C 20.4323 -16.1830
12 C8y C 19.1766 -15.4854
13 C8x C 19.1766 -14.0902
14 C8y C 17.9906 -13.3926
15 C8y C 16.8047 -14.0902
16 C8x C 16.8047 -15.4854
17 C8x C 17.9906 -16.1830
18 C1a C 22.8740 -17.5085
19 O2a O 15.6187 -17.5085
20 C1a C 14.3630 -18.2061
21 O2a O 15.6187 -20.3687
22 C1a C 14.3630 -19.6711
23 O2a O 15.5490 -13.3926
24 C1a C 15.5490 -11.9973
25 O1a O 17.9906 -11.9973
BOND 27
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 1 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 2 10 1
12 10 11 1 #Down
13 11 12 1
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 12 17 2
20 9 18 1
21 4 19 1
22 19 20 1
23 5 21 1
24 21 22 1
25 15 23 1
26 23 24 1
27 14 25 1
» Japanese version
DBGET
integrated database retrieval system
