Entry |
|
Name |
(R)-N-Methylcoclaurine;
(R)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol
|
Formula |
C18H21NO3
|
Exact mass |
299.1521
|
Mol weight |
299.36
|
Structure |
|
Reaction |
|
Pathway |
map00950 | Isoquinoline alkaloid biosynthesis |
|
Enzyme |
|
Brite |
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from tyrosine
Isoquinoline alkaloids
C05243 (R)-N-Methylcoclaurine
|
Other DBs |
|
KCF data |
ATOM 22
1 C8y C 25.8720 -21.9905
2 C1y C 27.0839 -21.2915
3 C8y C 25.8663 -23.3887
4 C8x C 24.6603 -21.2856
5 C1b C 27.0896 -19.8934
6 N1y N 28.2898 -22.0021
7 C8x C 24.6603 -24.0877
8 C1x C 27.0722 -24.0937
9 C8y C 23.4428 -21.9905
10 C8y C 28.2955 -19.1943
11 C1x C 28.2839 -23.4003
12 C1a C 29.5074 -21.3032
13 C8y C 23.4428 -23.3887
14 O1a O 22.2311 -21.2856
15 C8x C 28.3131 -17.7961
16 C8x C 29.5015 -19.9108
17 O2a O 22.2311 -24.0877
18 C8x C 29.5305 -17.1086
19 C8x C 30.7248 -19.2233
20 C1a C 21.0135 -23.3946
21 C8y C 30.7364 -17.8194
22 O1a O 31.9599 -17.1320
BOND 24
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1 #Up
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 6 12 1
12 7 13 1
13 9 14 1
14 10 15 2
15 10 16 1
16 13 17 1
17 15 18 1
18 16 19 2
19 17 20 1
20 18 21 2
21 21 22 1
22 8 11 1
23 9 13 2
24 19 21 1
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