KNApSAcK Metabolite C00040616
Metabolite
KNApSAcK Entry
| id | C00040616 |
|---|---|
| Name | Valeriotetrate C / (-)-Valeriotetrate C |
| CAS RN | 1026748-03-7 |
| Standard InChI | InChI=1S/C37H58O15/c1-19(2)12-27(39)50-26-15-36(44)25(16-46-33(42)30(22(7)8)51-28(40)13-20(3)4)17-47-35(49-24(11)38)32(36)37(26,45)18-48-34(43)31(23(9)10)52-29(41)14-21(5)6/h17,19-23,26,30-32,35,44-45H,12-16,18H2,1-11H3/t26-,30?,31?,32+,35+,36+,37-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C37H58O15/c1-19(2)12-27(39)50-26-15-36(44)25(16-46-33(42)30(22(7)8)51-28(40)13-20(3)4)17-47-35(49-24(11)38)32(36)37(26,45)18-48-34(43)31(23(9)10)52-29(41)14-21(5)6/h17,19-23,26,30-32,35,44-45H,12-16,18H2,1-11H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 483 |
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 |
|---|---|
| Caprifoliaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Valeriana wallichii | 19952 | Caprifoliaceae | asterids | Viridiplantae |