| Entry |
|
|---|
| Name |
L-Bornesitol;
(+)-Bornesitol;
3-O-Methyl-myo-inositol;
1D-3-O-Methyl-myo-inositol
|
|---|
| Formula |
C7H14O6
|
|---|
| Exact mass |
194.079
|
|---|
| Mol weight |
194.1825
|
|---|
| Structure |
|
|---|
| Comment |
formerly called "1-O-Methyl-myo-inositol" on old nomenclature system of numbering
|
|---|
| Reaction |
|
|---|
| Pathway |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 13
1 C1y C 18.5858 -15.7977
2 C1y C 17.4328 -15.1171
3 C1y C 19.7571 -15.1171
4 O2a O 18.5858 -17.1347
5 C1y C 17.4328 -13.7679
6 O1a O 16.2738 -15.7794
7 C1y C 19.7571 -13.7679
8 O1a O 20.9038 -15.7794
9 C1a C 20.2355 -17.8461
10 C1y C 18.5858 -13.0994
11 O1a O 16.0764 -13.0258
12 O1a O 20.9101 -13.0994
13 O1a O 18.5858 -11.8386
BOND 13
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 5 10 1
10 5 11 1 #Up
11 7 12 1 #Up
12 10 13 1 #Down
13 7 10 1
|
|---|
