KNApSAcK Metabolite C00039260
Metabolite
KNApSAcK Entry
| id | C00039260 |
|---|---|
| Name | Gentirigenic acid |
| CAS RN | 939791-45-4 |
| Standard InChI | InChI=1S/C30H50O7/c1-25(2)23(34)19(32)15-30(37-25,24(35)36)18-9-13-28(5)17(18)7-8-21-26(3)12-11-22(33)27(4,16-31)20(26)10-14-29(21,28)6/h17-23,31-34H,7-16H2,1-6H3,(H,35,36)/t17-,18+,19+,20-,21-,22+,23+,26+,27-,28-,29-,30+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H50O7/c1-25(2)23(34)19(32)15-30(37-25,24(35)36)18-9-13-28(5)17(18)7-8-21-26(3)12-11-22(33)27(4,16-31)20(26)10-14-29(21,28)6/h17-23,31-34H,7-16H2,1-6H3,(H,35,36) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 5380 |
Link
ChEMBL
| By standard InChI | CHEMBL387932 |
|---|---|
| By standard InChI Main Layer | CHEMBL387932 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Gentianaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Gentiana rigescens | 553056 | Gentianaceae | asterids | Viridiplantae |