KNApSAcK Metabolite C00003232
Metabolite
KNApSAcK Entry
| id | C00003232 |
|---|---|
| Name | Cnicin / (+)-Cnicin |
| CAS RN | 24394-09-0 |
| Standard InChI | InChI=1S/C20H26O7/c1-11-5-4-6-14(9-21)8-17-18(13(3)20(25)27-17)16(7-11)26-19(24)12(2)15(23)10-22/h5,8,15-18,21-23H,2-4,6-7,9-10H2,1H3/b11-5+,14-8-/t15?,16-,17+,18+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C20H26O7/c1-11-5-4-6-14(9-21)8-17-18(13(3)20(25)27-17)16(7-11)26-19(24)12(2)15(23)10-22/h5,8,15-18,21-23H,2-4,6-7,9-10H2,1H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 60 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL1257707 |
KEGG
| By LinkDB | C09362 |
|---|
CTD
| By CAS RN | C012849 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 3 |
Family
| family name | count |
|---|---|
| Asteraceae | 3 |
List (3)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Centaurea squarrosa | 41503 | Asteraceae | asterids | Viridiplantae |
| Centaurea thessala ssp.attica | 41503 | Asteraceae | asterids | Viridiplantae |
| Cnicus benedictus | 50282 | Asteraceae | asterids | Viridiplantae |
Human Protein / Gene in interaction
3 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P00734 | Prothrombin | S1A | CHEMBL1257707 |
CHEMBL2339330
(1)
|
4 / 2 |
| P53582 | Methionine aminopeptidase 1 | M24A | CHEMBL1257707 |
CHEMBL2339332
(1)
|
0 / 0 |
| P50579 | Methionine aminopeptidase 2 | M24A | CHEMBL1257707 |
CHEMBL2339331
(1)
|
0 / 0 |