KNApSAcK Metabolite C00040796
Metabolite
KNApSAcK Entry
| id | C00040796 |
|---|---|
| Name | 20,21alpha-Dihydroxy-22-oxo-21-desoxotingenone |
| CAS RN | 220223-70-1 |
| Standard InChI | InChI=1S/C28H36O5/c1-15-16-7-8-19-24(2,17(16)13-18(29)21(15)30)9-11-27(5)20-14-28(6,33)23(32)22(31)25(20,3)10-12-26(19,27)4/h7-8,13,20,23,30,32-33H,9-12,14H2,1-6H3/t20-,23-,24+,25-,26-,27+,28+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C28H36O5/c1-15-16-7-8-19-24(2,17(16)13-18(29)21(15)30)9-11-27(5)20-14-28(6,33)23(32)22(31)25(20,3)10-12-26(19,27)4/h7-8,13,20,23,30,32-33H,9-12,14H2,1-6H3 |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 403 |
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 |
|---|---|
| Celastraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Glyptopetalum sclerocarpum | 1089410 | Celastraceae | rosids | Viridiplantae |