KNApSAcK Metabolite C00038247
Metabolite
KNApSAcK Entry
| id | C00038247 |
|---|---|
| Name | 3beta,22alpha-Dihydroxyolean-12-en-30-oic acid / (+)-3beta,22alpha-Dihydroxyolean-12-en-30-oic acid |
| CAS RN | 938453-01-1 |
| Standard InChI | InChI=1S/C30H48O4/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3,24(33)34)17-23(32)27(19,4)14-15-29(18,30)6/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21+,22-,23-,26+,27+,28-,29+,30+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H48O4/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3,24(33)34)17-23(32)27(19,4)14-15-29(18,30)6/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34) |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 13 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL513961 CHEMBL458310 CHEMBL482783 CHEMBL520845 CHEMBL482586 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Asteraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Saussurea muliensis | 254917 | Asteraceae | asterids | Viridiplantae |