KNApSAcK Metabolite C00022568
Metabolite
KNApSAcK Entry
| id | C00022568 |
|---|---|
| Name | 4beta-Hydroxy-3alpha,6alpha,15,16-bis-epoxy-cis-clerodane-13(16),14-dien-20,12-olide |
| CAS RN | 129349-89-9 |
| Standard InChI | InChI=1S/C21H28O6/c1-12-9-21(24-4)18(2)15(5-6-16(27-21)19(18,3)23)20(12)10-14(26-17(20)22)13-7-8-25-11-13/h7-8,11-12,14-16,23H,5-6,9-10H2,1-4H3/t12-,14-,15+,16-,18+,19+,20-,21+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H28O6/c1-12-9-21(24-4)18(2)15(5-6-16(27-21)19(18,3)23)20(12)10-14(26-17(20)22)13-7-8-25-11-13/h7-8,11-12,14-16,23H,5-6,9-10H2,1-4H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 185 |
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 |
|---|---|---|---|---|
| Pteronia eenii | 72970 | Asteraceae | asterids | Viridiplantae |