KNApSAcK Metabolite C00003420
Metabolite
KNApSAcK Entry
| id | C00003420 |
|---|---|
| Name | Daphnetoxin |
| CAS RN | 28164-88-7 |
| Standard InChI | InChI=1S/C27H30O8/c1-13(2)23-11-15(4)26-17-10-14(3)19(29)25(17,31)22(30)24(12-28)21(32-24)18(26)20(23)33-27(34-23,35-26)16-8-6-5-7-9-16/h5-10,15,17-18,20-22,28,30-31H,1,11-12H2,2-4H3/t15-,17-,18-,20-,21+,22-,23-,24+,25-,26+,27?/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H30O8/c1-13(2)23-11-15(4)26-17-10-14(3)19(29)25(17,31)22(30)24(12-28)21(32-24)18(26)20(23)33-27(34-23,35-26)16-8-6-5-7-9-16/h5-10,15,17-18,20-22,28,30-31H,1,11-12H2,2-4H3 |
Cluster
| Phytochemical cluster | No. 41 |
|---|---|
| KCF-S cluster | No. 5420 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL2023369 |
KEGG
| By LinkDB | C09080 |
|---|
CTD
| By CAS RN | C452759 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Thymelaeaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Daphne mezereum | 66680 | Thymelaeaceae | rosids | Viridiplantae |