KNApSAcK Metabolite C00035234
Metabolite
KNApSAcK Entry
| id | C00035234 |
|---|---|
| Name | 6-O-Vanilloyl-ajugol / (-)-6-O-Vanilloyl-ajugol |
| CAS RN | 124168-04-3 |
| Standard InChI | InChI=1S/C23H30O12/c1-23(30)8-14(33-20(29)10-3-4-12(25)13(7-10)31-2)11-5-6-32-21(16(11)23)35-22-19(28)18(27)17(26)15(9-24)34-22/h3-7,11,14-19,21-22,24-28,30H,8-9H2,1-2H3/t11-,14+,15+,16+,17+,18-,19+,21-,22-,23-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C23H30O12/c1-23(30)8-14(33-20(29)10-3-4-12(25)13(7-10)31-2)11-5-6-32-21(16(11)23)35-22-19(28)18(27)17(26)15(9-24)34-22/h3-7,11,14-19,21-22,24-28,30H,8-9H2,1-2H3 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 287 |
Link
ChEMBL
| By standard InChI | CHEMBL1779142 |
|---|---|
| By standard InChI Main Layer | CHEMBL1779142 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Bignoniaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Tabebuia impetiginosa (MArt.ex.DC) | 39256 | Bignoniaceae | asterids | Viridiplantae |