KNApSAcK Metabolite C00003747
Metabolite
KNApSAcK Entry
| id | C00003747 |
|---|---|
| Name | Friedelin / Friedeline / Friedelanone / (-)-Friedelin / Friedelan-3-one |
| CAS RN | 559-74-0 |
| Standard InChI | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3 |
Cluster
| Phytochemical cluster | No. 52 |
|---|---|
| KCF-S cluster | No. 101 |
Link
ChEMBL
| By standard InChI | CHEMBL485998 |
|---|---|
| By standard InChI Main Layer | CHEMBL485998 CHEMBL1551590 |
KEGG
| By LinkDB | C08626 |
|---|
CTD
| By CAS RN | C060796 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 35 |
| asterids | 12 |
| eudicotyledons | 3 |
| Magnoliophyta | 2 |
| Spermatophyta | 1 |
| Euphyllophyta | 1 |
Family (Top 10)
| family name | count |
|---|---|
| Asteraceae | 5 |
| Calophyllaceae | 5 |
| Fabaceae | 4 |
| Celastraceae | 4 |
| Fagaceae | 4 |
| Clusiaceae | 3 |
| Hypericaceae | 3 |
| Campanulaceae | 2 |
| Polygonaceae | 2 |
| Phyllanthaceae | 2 |
List (58)
* NCBI
Human Protein / Gene in interaction
2 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| Q8TDU6 | G-protein coupled bile acid receptor 1 | Steroid-like ligand receptor | CHEMBL485998 |
CHEMBL1041788
(1)
CHEMBL1041789
(1)
|
0 / 0 |
| Q96RI1 | Bile acid receptor | NR1H4 | CHEMBL485998 |
CHEMBL1041790
(1)
|
0 / 0 |