KNApSAcK Metabolite C00012985
Metabolite
KNApSAcK Entry
| id | C00012985 |
|---|---|
| Name | Tirotundifolin E / (+)-Tirotundifolin E / Dodecahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2,3-dihydroxy-2-methylbutanoic acid |
| CAS RN | 92356-85-9 |
| Standard InChI | InChI=1S/C20H30O7/c1-9-6-7-13(22)19(4)8-12(26-18(24)20(5,25)11(3)21)14-10(2)17(23)27-16(14)15(9)19/h9,11-16,21-22,25H,2,6-8H2,1,3-5H3 |
| Standard InChI (Main Layer) | InChI=1S/C20H30O7/c1-9-6-7-13(22)19(4)8-12(26-18(24)20(5,25)11(3)21)14-10(2)17(23)27-16(14)15(9)19/h9,11-16,21-22,25H,2,6-8H2,1,3-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1128 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Asteraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Tithonia rotundifolia | 105388 | Asteraceae | asterids | Viridiplantae |