KNApSAcK Metabolite C00013048
Metabolite
KNApSAcK Entry
| id | C00013048 |
|---|---|
| Name | 9beta-Acetoxytournefortiolide / [3aS-(3aalpha,5beta,5abeta,9balpha)]-5-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one |
| CAS RN | 111394-34-4 |
| Standard InChI | InChI=1S/C17H22O4/c1-9-6-5-7-17(4)13(20-11(3)18)8-12-10(2)16(19)21-15(12)14(9)17/h12-13,15H,2,5-8H2,1,3-4H3/t12-,13-,15+,17+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C17H22O4/c1-9-6-5-7-17(4)13(20-11(3)18)8-12-10(2)16(19)21-15(12)14(9)17/h12-13,15H,2,5-8H2,1,3-4H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 157 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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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 |
|---|---|---|---|---|
| Artemisia tournefortiana | 72354 | Asteraceae | asterids | Viridiplantae |