| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C20H26O6
|
|---|
| Exact mass |
362.1729
|
|---|
| Mol weight |
362.4168
|
|---|
| Structure |
|
|---|
| Comment |
(-)-Secoisolariciresinol [CPD: C18167]
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00999 | Biosynthesis of various plant secondary metabolites |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Phenylpropanoids
Lignans
Lignans
C20456 (+)-Secoisolariciresinol
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 26
1 C8y C 13.1261 -16.5494
2 C8y C 13.1261 -17.9461
3 C8x C 14.3356 -18.6444
4 C8x C 15.5452 -17.9461
5 C8y C 15.5452 -16.5494
6 C8x C 14.3356 -15.8511
7 C1b C 16.7798 -15.8511
8 C1c C 17.9894 -16.5494
9 C1c C 19.1989 -15.8511
10 C1b C 20.4084 -16.5494
11 C8y C 21.6180 -15.8511
12 C8x C 22.8482 -16.5616
13 C8y C 24.0579 -15.8635
14 C8y C 24.0581 -14.4668
15 C8x C 22.8279 -13.7563
16 C8x C 21.6182 -14.4544
17 O1a O 11.9166 -18.6444
18 O2a O 11.9166 -15.8511
19 C1a C 10.7240 -16.5399
20 O2a O 25.2855 -16.5731
21 C1a C 26.4991 -15.8732
22 O1a O 25.2969 -13.7517
23 C1b C 17.9894 -17.9459
24 C1b C 19.1989 -14.4544
25 O1a O 20.4105 -13.7549
26 O1a O 16.7986 -18.6334
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 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 11 16 1
18 2 17 1
19 1 18 1
20 18 19 1
21 13 20 1
22 20 21 1
23 14 22 1
24 8 23 1 #Up
25 9 24 1 #Up
26 24 25 1
27 23 26 1
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|---|
