KNApSAcK Metabolite C00013051
Metabolite
KNApSAcK Entry
| id | C00013051 |
|---|---|
| Name | Dehydrobrachylaenolide / [3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-Hexahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2,8(3H,4H)-dione |
| CAS RN | 82460-97-7 |
| Standard InChI | InChI=1S/C15H16O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7,10,12-13H,1-2,4,6H2,3H3/t10-,12+,13-,15-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C15H16O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7,10,12-13H,1-2,4,6H2,3H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 1231 |
Link
ChEMBL
| By standard InChI | CHEMBL1966024 |
|---|---|
| By standard InChI Main Layer | CHEMBL465782 CHEMBL1966024 |
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 |
|---|---|---|---|---|
| Brachylaena transvaalensis | 992654 | Asteraceae | asterids | Viridiplantae |