KNApSAcK Metabolite C00046773
Metabolite
KNApSAcK Entry
| id | C00046773 |
|---|---|
| Name | Ialibinone B / (-)-Ialibinone B |
| CAS RN | 256471-47-3 |
| Standard InChI | InChI=1S/C21H28O4/c1-10(2)12-8-21-13(19(12,5)6)9-20(7,18(21)25)16(23)14(17(21)24)15(22)11(3)4/h11-13,23H,1,8-9H2,2-7H3/t12-,13+,20+,21?/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H28O4/c1-10(2)12-8-21-13(19(12,5)6)9-20(7,18(21)25)16(23)14(17(21)24)15(22)11(3)4/h11-13,23H,1,8-9H2,2-7H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1473 |
Link
ChEMBL
| By standard InChI | CHEMBL519630 |
|---|---|
| By standard InChI Main Layer | CHEMBL481435 CHEMBL519630 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Hypericaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Hypericum papuanum | 1137007 | Hypericaceae | rosids | Viridiplantae |