KNApSAcK Metabolite C00047660
Metabolite
KNApSAcK Entry
| id | C00047660 |
|---|---|
| Name | alpha-Peltoboykinolic acid / (+)-alpha-Peltoboykinolic acid / 3beta-Hydroxyurs-12-en-27-oic acid |
| CAS RN | 24778-49-2 |
| Standard InChI | InChI=1S/C30H48O3/c1-18-10-13-27(5)16-17-30(25(32)33)20(24(27)19(18)2)8-9-22-28(6)14-12-23(31)26(3,4)21(28)11-15-29(22,30)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19+,21+,22-,23+,24+,27-,28+,29-,30-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H48O3/c1-18-10-13-27(5)16-17-30(25(32)33)20(24(27)19(18)2)8-9-22-28(6)14-12-23(31)26(3,4)21(28)11-15-29(22,30)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33) |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 13 |
Link
ChEMBL
| By standard InChI | CHEMBL509107 |
|---|---|
| By standard InChI Main Layer | CHEMBL380467 CHEMBL509107 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 2 |
Family
| family name | count |
|---|---|
| Saxifragaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Astilbe chinensis | 268493 | Saxifragaceae | eudicotyledons | Viridiplantae |
| Peltoboykinia watanabii | 23260 | Saxifragaceae | eudicotyledons | Viridiplantae |
Human Protein / Gene in interaction
1 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P18031 | Tyrosine-protein phosphatase non-receptor type 1 | Tyr | CHEMBL380467 |
CHEMBL854300
(1)
|
0 / 0 |