KNApSAcK Metabolite C00029441
Metabolite
KNApSAcK Entry
| id | C00029441 |
|---|---|
| Name | 20-Epibryonolic acid |
| CAS RN | 1038596-76-7 |
| Standard InChI | InChI=1S/C30H48O3/c1-25(2)21-9-8-20-19(28(21,5)12-11-23(25)31)10-13-30(7)22-18-27(4,24(32)33)15-14-26(22,3)16-17-29(20,30)6/h21-23,31H,8-18H2,1-7H3,(H,32,33)/t21-,22+,23-,26+,27-,28+,29+,30-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H48O3/c1-25(2)21-9-8-20-19(28(21,5)12-11-23(25)31)10-13-30(7)22-18-27(4,24(32)33)15-14-26(22,3)16-17-29(20,30)6/h21-23,31H,8-18H2,1-7H3,(H,32,33) |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 13 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL482596 CHEMBL1982562 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 3 |
Family
| family name | count |
|---|---|
| Cannabaceae | 1 |
| Cucurbitaceae | 1 |
| Euphorbiaceae | 1 |
List (3)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Celtis philippinensis | 213552 | Cannabaceae | rosids | Viridiplantae |
| Lagenaria siceraria (MOL.) STANDL | 3667 | Cucurbitaceae | rosids | Viridiplantae |
| Macaranga conifera | 109817 | Euphorbiaceae | rosids | Viridiplantae |