KNApSAcK Metabolite C00037661
Metabolite
KNApSAcK Entry
| id | C00037661 |
|---|---|
| Name | Polpunoic acid |
| CAS RN | 33600-93-0 |
| Standard InChI | InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,4)11-10-22-28(21,5)15-17-30(7)23-18-26(3,24(32)33)13-12-25(23,2)14-16-29(22,30)6/h19,21-23H,8-18H2,1-7H3,(H,32,33)/t19-,21+,22-,23+,25+,26+,27+,28-,29+,30-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,4)11-10-22-28(21,5)15-17-30(7)23-18-26(3,24(32)33)13-12-25(23,2)14-16-29(22,30)6/h19,21-23H,8-18H2,1-7H3,(H,32,33) |
Cluster
| Phytochemical cluster | No. 52 |
|---|---|
| KCF-S cluster | No. 101 |
Link
ChEMBL
| By standard InChI | CHEMBL458132 |
|---|---|
| By standard InChI Main Layer | CHEMBL458132 CHEMBL483029 CHEMBL1163498 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C001687 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 2 |
Family
| family name | count |
|---|---|
| Celastraceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Tripterygium doianum | 859951 | Celastraceae | rosids | Viridiplantae |
| Tripterygium wilfordii Hook f. | 123484 | Celastraceae | rosids | Viridiplantae |