KNApSAcK Metabolite C00000888
Metabolite
KNApSAcK Entry
| id | C00000888 |
|---|---|
| Name | Labdenediol / 13E-Labdene-8alpha,15-diol |
| CAS RN | 10267-31-9 |
| Standard InChI | InChI=1S/C20H36O2/c1-15(10-14-21)7-8-17-19(4)12-6-11-18(2,3)16(19)9-13-20(17,5)22/h10,16-17,21-22H,6-9,11-14H2,1-5H3/b15-10+/t16-,17+,19-,20+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C20H36O2/c1-15(10-14-21)7-8-17-19(4)12-6-11-18(2,3)16(19)9-13-20(17,5)22/h10,16-17,21-22H,6-9,11-14H2,1-5H3 |
Cluster
| Phytochemical cluster | No. 46 |
|---|---|
| KCF-S cluster | No. 118 |
Link
ChEMBL
| By standard InChI | CHEMBL1644112 |
|---|---|
| By standard InChI Main Layer | CHEMBL589839 CHEMBL1644112 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
| Embryophyta | 1 |
Family
| family name | count |
|---|---|
| Solanaceae | 1 |
| Jungermanniaceae | 1 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Jungermannia infusca | 362815 | Jungermanniaceae | Embryophyta | Viridiplantae |
| Nicotiana glutinosa | 35889 | Solanaceae | asterids | Viridiplantae |