KNApSAcK Metabolite C00029724
Metabolite
KNApSAcK Entry
| id | C00029724 |
|---|---|
| Name | Arjunolic acid |
| CAS RN | 465-00-9 |
| Standard InChI | InChI=1S/C30H48O5/c1-25(2)11-13-30(24(34)35)14-12-28(5)18(19(30)15-25)7-8-22-26(3)16-20(32)23(33)27(4,17-31)21(26)9-10-29(22,28)6/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t19-,20+,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H48O5/c1-25(2)11-13-30(24(34)35)14-12-28(5)18(19(30)15-25)7-8-22-26(3)16-20(32)23(33)27(4,17-31)21(26)9-10-29(22,28)6/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35) |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 13 |
Link
ChEMBL
| By standard InChI | CHEMBL464466 |
|---|---|
| By standard InChI Main Layer | CHEMBL464466 CHEMBL1774425 CHEMBL1797308 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C061640 |
|---|
Species
Summary
Family
| family name | count |
|---|---|
| Combretaceae | 4 |
| Myrtaceae | 3 |
| Ulmaceae | 1 |
| Lamiaceae | 1 |
| Malvaceae | 1 |
List (10)
* 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 | CHEMBL464466 |
CHEMBL1041788
(1)
CHEMBL1041789
(1)
|
0 / 0 |
| Q96RI1 | Bile acid receptor | NR1H4 | CHEMBL464466 |
CHEMBL1041790
(1)
|
0 / 0 |