KNApSAcK Metabolite C00050112
Metabolite
KNApSAcK Entry
| id | C00050112 |
|---|---|
| Name | Guanepolide / (-)-Guanepolide |
| CAS RN | 80458-49-7 |
| Standard InChI | InChI=1S/C27H34O9/c1-13(29)34-15-11-24(2,23-14(12-28)8-20(31)36-23)16-10-21(32)35-19-9-17-25(3,33)7-6-18(30)26(17,4)22(15)27(16,19)5/h6-7,10,14-15,17,19,22-23,28,33H,8-9,11-12H2,1-5H3/t14-,15-,17+,19-,22-,23+,24-,25-,26-,27-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H34O9/c1-13(29)34-15-11-24(2,23-14(12-28)8-20(31)36-23)16-10-21(32)35-19-9-17-25(3,33)7-6-18(30)26(17,4)22(15)27(16,19)5/h6-7,10,14-15,17,19,22-23,28,33H,8-9,11-12H2,1-5H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 7514 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL476294 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Simaroubaceae | 1 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Simaba cf.orinocensis | 43726 | Simaroubaceae | rosids | Viridiplantae |
| Simba cedron |