KNApSAcK Metabolite C00036675
Metabolite
KNApSAcK Entry
| id | C00036675 |
|---|---|
| Name | Abruslactone A |
| CAS RN | 84104-71-2 |
| Standard InChI | InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3/t19-,20-,21+,22-,23-,26-,27+,28-,29+,30+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H46O3/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3)17-23(33-24(26)32)27(19,4)14-15-29(18,30)6/h8,19-23,31H,9-17H2,1-7H3 |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 13 |
Link
ChEMBL
| By standard InChI | CHEMBL484424 |
|---|---|
| By standard InChI Main Layer | CHEMBL468457 CHEMBL484855 CHEMBL484424 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C052981 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 2 |
Family
| family name | count |
|---|---|
| Celastraceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Maytenus loevis | 123430 | Celastraceae | rosids | Viridiplantae |
| Tripterygium wilfordii Hook f. | 123484 | Celastraceae | rosids | Viridiplantae |