KNApSAcK Metabolite C00003226
Metabolite
KNApSAcK Entry
| id | C00003226 |
|---|---|
| Name | Budlein A |
| CAS RN | 59481-48-0 |
| Standard InChI | InChI=1S/C20H22O7/c1-5-10(2)18(23)26-15-8-20(4)16(22)7-13(27-20)12(9-21)6-14-17(15)11(3)19(24)25-14/h5-7,14-15,17,21H,3,8-9H2,1-2,4H3/b10-5-,12-6-/t14-,15-,17+,20-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C20H22O7/c1-5-10(2)18(23)26-15-8-20(4)16(22)7-13(27-20)12(9-21)6-14-17(15)11(3)19(24)25-14/h5-7,14-15,17,21H,3,8-9H2,1-2,4H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 366 |
Link
ChEMBL
| By standard InChI | CHEMBL1173297 |
|---|---|
| By standard InChI Main Layer | CHEMBL189707 CHEMBL188697 CHEMBL382151 CHEMBL1173297 |
KEGG
| By LinkDB | C09351 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 4 |
Family
| family name | count |
|---|---|
| Asteraceae | 4 |
List (4)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Viguiera angustifolia | 684026 | Asteraceae | asterids | Viridiplantae |
| Viguiera buddleiaeformis | 73317 | Asteraceae | asterids | Viridiplantae |
| Viguiera eriophora ssp.eriophora | 73317 | Asteraceae | asterids | Viridiplantae |
| Viguiera robusta | 99458 | 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) |
|---|---|---|---|---|---|
| Q04206 | Transcription factor p65 | Transcription Factor | CHEMBL189707 CHEMBL382151 CHEMBL188697 |
CHEMBL828644
(2)
CHEMBL835063
(2)
CHEMBL861583 (2) |
0 / 0 |
| Q00653 | Nuclear factor NF-kappa-B p100 subunit | Transcription Factor | CHEMBL189707 CHEMBL188697 |
CHEMBL828644
(2)
CHEMBL835063
(2)
|
0 / 0 |
| P19838 | Nuclear factor NF-kappa-B p105 subunit | Transcription Factor | CHEMBL189707 CHEMBL188697 |
CHEMBL828644
(2)
CHEMBL835063
(2)
|
0 / 0 |