KNApSAcK Metabolite C00042260
Metabolite
KNApSAcK Entry
| id | C00042260 |
|---|---|
| Name | Avarol / (+)-Avarol |
| CAS RN | 55303-98-5 |
| Standard InChI | InChI=1S/C21H30O2/c1-14-6-5-7-19-20(14,3)11-10-15(2)21(19,4)13-16-12-17(22)8-9-18(16)23/h6,8-9,12,15,19,22-23H,5,7,10-11,13H2,1-4H3/t15-,19+,20+,21+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C21H30O2/c1-14-6-5-7-19-20(14,3)11-10-15(2)21(19,4)13-16-12-17(22)8-9-18(16)23/h6,8-9,12,15,19,22-23H,5,7,10-11,13H2,1-4H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 814 |
Link
ChEMBL
| By standard InChI | CHEMBL459814 |
|---|---|
| By standard InChI Main Layer | CHEMBL23015 CHEMBL459814 CHEMBL1983789 CHEMBL1984731 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C023663 |
|---|
Species
Summary
Plant class
| class name | count |
|---|
Family
| family name | count |
|---|---|
| Dysideidae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Dysidea avara | 196820 | Dysideidae | Metazoa |
Human Protein / Gene in interaction
3 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P35354 | Prostaglandin G/H synthase 2 | Oxidoreductase | CHEMBL459814 |
CHEMBL1008495
(1)
|
0 / 3 |
| P11597 | Cholesteryl ester transfer protein | Secreted protein | CHEMBL459814 |
CHEMBL653305
(1)
|
1 / 1 |
| P22303 | Acetylcholinesterase | Hydrolase | CHEMBL459814 |
CHEMBL1042165
(1)
|
1 / 0 |
CTD interaction (5)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| C023663 | 3576 |
IL8
CXCL8 GCP-1 GCP1 LECT LUCT LYNAP MDNCF MONAP NAF NAP-1 NAP1 |
interleukin 8 | avarol analog results in decreased expression of IL8 mRNA |
decreases expression
|
mRNA |
16973179
|
| C023663 | 5743 |
PTGS2
COX-2 COX2 GRIPGHS PGG/HS PGHS-2 PHS-2 hCox-2 |
prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1) | avarol analog results in decreased expression of PTGS2 mRNA |
decreases expression
|
mRNA |
16973179
|
| C023663 | 5743 |
PTGS2
COX-2 COX2 GRIPGHS PGG/HS PGHS-2 PHS-2 hCox-2 |
prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1) | avarol analog results in decreased expression of PTGS2 protein |
decreases expression
|
protein |
16973179
|
| C023663 | 7124 |
TNF
DIF TNF-alpha TNFA TNFSF2 |
tumor necrosis factor | avarol analog results in decreased expression of TNF mRNA |
decreases expression
|
mRNA |
16973179
|
| C023663 | 7124 |
TNF
DIF TNF-alpha TNFA TNFSF2 |
tumor necrosis factor | avarol analog results in decreased expression of TNF protein |
decreases expression
|
protein |
16973179
|