KNApSAcK Metabolite C00003082
Metabolite
KNApSAcK Entry
| id | C00003082 |
|---|---|
| Name | Gentiopicrin / Gentiopicroside |
| CAS RN | 20831-76-9 |
| Standard InChI | InChI=1S/C16H20O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2-3,6-7,10-13,15-20H,1,4-5H2/t7-,10?,11-,12+,13?,15+,16+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C16H20O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2-3,6-7,10-13,15-20H,1,4-5H2 |
Cluster
| Phytochemical cluster | No. 36 |
|---|---|
| KCF-S cluster | No. 3781 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL508320 |
KEGG
| By LinkDB | C09782 |
|---|
CTD
| By CAS RN | C012997 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 5 |
Family
| family name | count |
|---|---|
| Gentianaceae | 5 |
List (6)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Gentiana lutea | 38851 | Gentianaceae | asterids | Viridiplantae |
| Gentiana manshurica | 683755 | Gentianaceae | asterids | Viridiplantae |
| Gentiana rigescens | 553056 | Gentianaceae | asterids | Viridiplantae |
| Gentiana scabra | 292393 | Gentianaceae | asterids | Viridiplantae |
| Radix gentianae | ||||
| Swertia franchetiana | 50785 | Gentianaceae | asterids | Viridiplantae |
Human Protein / Gene in interaction
2 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P84022 | Mothers against decapentaplegic homolog 3 | Unclassified protein | CHEMBL508320 |
CHEMBL1794584
(1)
|
2 / 0 |
| P83916 | Chromobox protein homolog 1 | Unclassified protein | CHEMBL508320 |
CHEMBL1794401
(1)
|
0 / 0 |
Related Disease
Diseases related to proteins in ChEMBL interactions
OMIM (2)
| OMIM | preferred title | UniProt |
|---|---|---|
| #114500 | Colorectal cancer; crc |
P84022
|
| #613795 | Loeys-dietz syndrome, type 3; lds3 |
P84022
|