KNApSAcK Metabolite C00012594
Metabolite
KNApSAcK Entry
| id | C00012594 |
|---|---|
| Name | [7'R(R)]-7'-Deoxo-16-hydroxy-7'-(1-hydroxyethyl)verrucarin A |
| CAS RN | 87532-28-3 |
| Standard InChI | InChI=1S/C29H40O10/c1-18-8-11-36-29(34,19(2)31)9-5-4-6-24(32)39-21-14-23-28(17-37-28)26(21,3)27(16-35-25(33)12-18)10-7-20(15-30)13-22(27)38-23/h4-6,9,13,18-19,21-23,30-31,34H,7-8,10-12,14-17H2,1-3H3/b6-4-,9-5+/t18-,19-,21-,22-,23-,26-,27-,28+,29-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C29H40O10/c1-18-8-11-36-29(34,19(2)31)9-5-4-6-24(32)39-21-14-23-28(17-37-28)26(21,3)27(16-35-25(33)12-18)10-7-20(15-30)13-22(27)38-23/h4-6,9,13,18-19,21-23,30-31,34H,7-8,10-12,14-17H2,1-3H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 84 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
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 |
|---|---|---|---|---|
| Baccharis megapotamica | 41487 | Asteraceae | asterids | Viridiplantae |