KNApSAcK Metabolite C00012267
Metabolite
KNApSAcK Entry
| id | C00012267 |
|---|---|
| Name | 2,3,3a,4,5,8,9,11a-Octahydro-6,10-bis(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid |
| CAS RN | 70855-63-9 |
| Standard InChI | InChI=1S/C20H28O6/c1-4-12(2)19(23)25-16-8-14(10-21)6-5-7-15(11-22)9-17-18(16)13(3)20(24)26-17/h6,9,12,16-18,21-22H,3-5,7-8,10-11H2,1-2H3/b14-6+,15-9+ |
| Standard InChI (Main Layer) | InChI=1S/C20H28O6/c1-4-12(2)19(23)25-16-8-14(10-21)6-5-7-15(11-22)9-17-18(16)13(3)20(24)26-17/h6,9,12,16-18,21-22H,3-5,7-8,10-11H2,1-2H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 211 |
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 |
|---|---|---|---|---|
| Cnicothamnus lorentzii | 130253 | Asteraceae | asterids | Viridiplantae |