KNApSAcK Metabolite C00003172
Metabolite
KNApSAcK Entry
| id | C00003172 |
|---|---|
| Name | Phytuberin / (-)-Phytuberin / (3aR,5aS,8R,9aR)-5,5a,6,7,8,9-Hexahydro-a,a,3a,5a-tetramethyl-3aH-furo[3,2-c]isobenzofuran-8-methanol acetate |
| CAS RN | 37209-50-0 |
| Standard InChI | InChI=1S/C17H26O4/c1-12(18)21-14(2,3)13-6-7-15(4)11-20-16(5)8-9-19-17(15,16)10-13/h8-9,13H,6-7,10-11H2,1-5H3/t13-,15+,16-,17-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C17H26O4/c1-12(18)21-14(2,3)13-6-7-15(4)11-20-16(5)8-9-19-17(15,16)10-13/h8-9,13H,6-7,10-11H2,1-5H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 5122 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB | C09709 |
|---|
CTD
| By CAS RN | C008908 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Enterobacteriaceae | 1 |
| Solanaceae | 1 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Erwinia carotovora | 554 | Enterobacteriaceae | Bacteria | |
| Solanum tuberosum | 4113 | Solanaceae | asterids | Viridiplantae |