KNApSAcK Metabolite C00012924
Metabolite
KNApSAcK Entry
| id | C00012924 |
|---|---|
| Name | 15-Acetoxyisoalloalantolactone / [3aR-(3aalpha,4aalpha,8abeta,9aalpha)]- 5-[(Acetyloxy)methyl]-3a,4,4a,7,8,8a,9,9a-octahydro-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one |
| CAS RN | 119285-34-6 |
| Standard InChI | InChI=1S/C17H22O4/c1-10-13-7-14-12(9-20-11(2)18)5-4-6-17(14,3)8-15(13)21-16(10)19/h5,13-15H,1,4,6-9H2,2-3H3/t13-,14+,15-,17-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C17H22O4/c1-10-13-7-14-12(9-20-11(2)18)5-4-6-17(14,3)8-15(13)21-16(10)19/h5,13-15H,1,4,6-9H2,2-3H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 157 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
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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 |
|---|---|---|---|---|
| Ambrosia artemisioides | 4211 | Asteraceae | asterids | Viridiplantae |