KNApSAcK Metabolite C00039936
Metabolite
KNApSAcK Entry
| id | C00039936 |
|---|---|
| Name | Pedonin |
| CAS RN | 108529-71-1 |
| Standard InChI | InChI=1S/C27H32O9/c1-22(2)26(11-8-18(29)35-22)13-17(28)24(4)16(25(26,5)32)7-10-23(3,19(30)15-9-12-34-14-15)27(24)20(36-27)21(31)33-6/h8-9,11-12,14,16,20,32H,7,10,13H2,1-6H3/t16-,20+,23-,24-,25-,26-,27+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H32O9/c1-22(2)26(11-8-18(29)35-22)13-17(28)24(4)16(25(26,5)32)7-10-23(3,19(30)15-9-12-34-14-15)27(24)20(36-27)21(31)33-6/h8-9,11-12,14,16,20,32H,7,10,13H2,1-6H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 4911 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Simaroubaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Harrisonia abyssinica | 557062 | Simaroubaceae | rosids | Viridiplantae |