KNApSAcK Metabolite C00038019
Metabolite
KNApSAcK Entry
| id | C00038019 |
|---|---|
| Name | Withacoagulin / (+)-Withacoagulin |
| CAS RN | 601479-14-5 |
| Standard InChI | InChI=1S/C28H36O5/c1-16-14-24(33-25(31)19(16)15-29)28(4,32)22-11-10-20-18-9-8-17-6-5-7-23(30)27(17,3)21(18)12-13-26(20,22)2/h5,7-8,10,18,21-22,24,29,32H,6,9,11-15H2,1-4H3/t18-,21-,22-,24+,26-,27-,28+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C28H36O5/c1-16-14-24(33-25(31)19(16)15-29)28(4,32)22-11-10-20-18-9-8-17-6-5-7-23(30)27(17,3)21(18)12-13-26(20,22)2/h5,7-8,10,18,21-22,24,29,32H,6,9,11-15H2,1-4H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 7792 |
Link
ChEMBL
| By standard InChI | CHEMBL2333676 |
|---|---|
| By standard InChI Main Layer | CHEMBL2333676 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Solanaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Withania coagulans | 180581 | Solanaceae | asterids | Viridiplantae |