KNApSAcK Metabolite C00036697
Metabolite
KNApSAcK Entry
| id | C00036697 |
|---|---|
| Name | Agrostophyllinone |
| CAS RN | 56795-59-6 |
| Standard InChI | InChI=1S/C31H50O/c1-20(2)21(3)10-11-22(4)23-14-18-31(9)25-12-13-26-28(5,6)27(32)16-17-29(26,7)24(25)15-19-30(23,31)8/h15,20,22-23,25-26H,3,10-14,16-19H2,1-2,4-9H3/t22-,23-,25-,26+,29-,30-,31+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C31H50O/c1-20(2)21(3)10-11-22(4)23-14-18-31(9)25-12-13-26-28(5,6)27(32)16-17-29(26,7)24(25)15-19-30(23,31)8/h15,20,22-23,25-26H,3,10-14,16-19H2,1-2,4-9H3 |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 119 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| Liliopsida | 2 |
Family
| family name | count |
|---|---|
| Orchidaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Agrostophyllum brevipes | 163261 | Orchidaceae | Liliopsida | Viridiplantae |
| Agrostophyllum callosum | 163261 | Orchidaceae | Liliopsida | Viridiplantae |