KNApSAcK Metabolite C00045597
Metabolite
KNApSAcK Entry
| id | C00045597 |
|---|---|
| Name | 9(13)-Cyclodiscodermolide / (+)-9(13)-Cyclodiscodermolide |
| CAS RN | 476172-88-0 |
| Standard InChI | InChI=1S/C33H53NO7/c1-10-11-13-17(2)31(41-33(34)39)23(8)28(35)19(4)16-18(3)27-22(7)29(36)20(5)25(27)14-12-15-26-21(6)30(37)24(9)32(38)40-26/h10-14,16-17,19-31,35-37H,1,15H2,2-9H3,(H2,34,39)/b13-11-,14-12+,18-16+/t17?,19?,20?,21-,22?,23?,24-,25?,26+,27?,28?,29?,30+,31?/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C33H53NO7/c1-10-11-13-17(2)31(41-33(34)39)23(8)28(35)19(4)16-18(3)27-22(7)29(36)20(5)25(27)14-12-15-26-21(6)30(37)24(9)32(38)40-26/h10-14,16-17,19-31,35-37H,1,15H2,2-9H3,(H2,34,39) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 5241 |
Link
ChEMBL
| By standard InChI | CHEMBL505694 |
|---|---|
| By standard InChI Main Layer | CHEMBL449683 CHEMBL505694 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|---|
| Theonellidae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Discodermia sp. | 73796 | Theonellidae | Metazoa |