| Entry |
|
|---|
| Name |
2-Methoxy-17beta-estradiol;
2-Methoxyestradiol-17beta
|
|---|
| Formula |
C19H26O3
|
|---|
| Exact mass |
302.1882
|
|---|
| Mol weight |
302.4079
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
|
|---|
| Enzyme |
|
|---|
| Brite |
Compounds with biological roles [BR:br08001]
Steroids
18-Carbon atoms
Estrane derivatives
C05302 2-Methoxyestradiol-17beta
Lipids [BR:br08002]
ST Sterol lipids
ST02 Steroids
ST0201 C18 steroids (estrogens) and derivatives
C05302 2-Methoxyestradiol-17beta
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 22
1 C1y C 28.8985 -17.3191
2 C1y C 30.0740 -18.0150
3 C8y C 27.7114 -18.0033
4 C1x C 28.9102 -15.9624
5 C1y C 31.2552 -17.3366
6 C1x C 30.0740 -19.3776
7 C8y C 27.7054 -19.3659
8 C8x C 26.5300 -17.3191
9 C1x C 30.0974 -15.2898
10 C1z C 31.2611 -15.9799
11 C1x C 33.6003 -17.3658
12 C1x C 28.8868 -20.0501
13 C8x C 26.5300 -20.0443
14 C8y C 25.3545 -18.0033
15 C1y C 32.4483 -15.3132
16 C1a C 31.2552 -14.6173
17 C1x C 33.6178 -16.0090
18 C8y C 25.3488 -19.3659
19 O2a O 24.1440 -17.3015
20 O1a O 32.4423 -13.9447
21 O1a O 24.1616 -20.0443
22 C1a C 24.1440 -15.9039
BOND 25
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 8 14 2
14 10 15 1
15 10 16 1 #Up
16 11 17 1
17 13 18 2
18 14 19 1
19 15 20 1 #Up
20 18 21 1
21 19 22 1
22 7 12 1
23 9 10 1
24 14 18 1
25 15 17 1
|
|---|
