| Entry |
|
|---|
| Name |
Amygdalin;
(R)-Amygdalin;
(R)-Amygdaloside;
(R)-Laenitrile
|
|---|
| Formula |
C20H27NO11
|
|---|
| Exact mass |
457.1584
|
|---|
| Mol weight |
457.4285
|
|---|
| Structure |
|
|---|
| Reaction |
R02985 R10639
|
|---|
| Pathway |
| map00460 | Cyanoamino acid metabolism |
| map01100 | Metabolic pathways |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
3.2.1.21 3.2.1.117
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Amino acid related compounds
Cyanogenic glucosides
Cyanogenic glucosides derived from phenylalanine
C08325 Amygdalin
Natural toxins [BR:br08009]
Phytotoxins
Glycosides
Cyanogenic glycosides
C08325 Amygdalin
Glycosides [BR:br08021]
O-glycosides
Cyanogenic glycosides
C08325 Amygdalin
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 32
1 C1y C 20.9096 -15.4509
2 O2x O 19.6886 -14.7498
3 O2a O 22.1191 -14.7498
4 C1y C 20.9096 -16.8532
5 C1y C 18.4851 -15.4509
6 C1c C 23.3226 -15.4509
7 C1y C 19.6886 -17.5543
8 O1a O 22.1191 -17.5543
9 C1y C 18.4851 -16.8532
10 C1b C 17.2697 -14.7498
11 C8y C 24.4970 -14.7088
12 O1a O 19.6886 -18.9566
13 O1a O 17.2697 -17.5543
14 O2a O 16.2005 -15.6612
15 C8x C 24.5086 -13.3123
16 C8x C 25.7358 -15.3516
17 C1y C 14.9910 -16.3683
18 C8x C 25.6189 -12.5588
19 C8x C 26.9158 -14.6036
20 O2x O 13.7640 -15.6671
21 C1y C 14.9910 -17.7705
22 C8x C 26.9274 -13.2130
23 C1y C 12.5604 -16.3740
24 C1y C 13.7640 -18.4717
25 O1a O 16.1946 -18.4717
26 C1y C 12.5604 -17.7705
27 C1b C 11.3452 -15.6671
28 O1a O 13.7640 -19.8737
29 O1a O 11.3452 -18.4717
30 O1a O 10.2759 -16.5785
31 C3b C 23.3694 -16.8473
32 N3a N 23.3519 -18.2438
BOND 34
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 3 6 1
6 4 7 1
7 4 8 1 #Down
8 5 9 1
9 5 10 1 #Up
10 6 11 1
11 7 12 1 #Up
12 9 13 1 #Down
13 10 14 1
14 11 15 2
15 11 16 1
16 17 14 1 #Up
17 15 18 1
18 16 19 2
19 17 20 1
20 17 21 1
21 18 22 2
22 20 23 1
23 21 24 1
24 21 25 1 #Down
25 23 26 1
26 23 27 1 #Up
27 24 28 1 #Up
28 26 29 1 #Down
29 27 30 1
30 7 9 1
31 19 22 1
32 24 26 1
33 31 32 3
34 6 31 1 #Down
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|---|