KNApSAcK Metabolite C00016987
Metabolite
KNApSAcK Entry
| id | C00016987 |
|---|---|
| Name | Nootkatone / Nootkanone / (+)-Nootkatone / 4betaH,5alpha-Eremophila-1(10),11-dien-2-one |
| CAS RN | 4674-50-4 |
| Standard InChI | InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3 |
Cluster
| Phytochemical cluster | No. 38 |
|---|---|
| KCF-S cluster | No. 543 |
Link
ChEMBL
| By standard InChI | CHEMBL446299 |
|---|---|
| By standard InChI Main Layer | CHEMBL446299 |
KEGG
| By LinkDB | C17914 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| Spermatophyta | 2 |
| rosids | 1 |
| Liliopsida | 1 |
Family
| family name | count |
|---|---|
| Cupressaceae | 2 |
| Rutaceae | 1 |
| Zingiberaceae | 1 |
List (4)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Alpinia oxyphylla | 125261 | Zingiberaceae | Liliopsida | Viridiplantae |
| Chamaecyparis nootkatensis | 85954 | Cupressaceae | Spermatophyta | Viridiplantae |
| Citrus paradisi L. | 2706 | Rutaceae | rosids | Viridiplantae |
| Juniperus brevifolia | 746017 | Cupressaceae | Spermatophyta | Viridiplantae |
Human Protein / Gene in interaction
4 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| Q9Y6L6 | Solute carrier organic anion transporter family member 1B1 | Electrochemical transporter | CHEMBL446299 |
CHEMBL2169429
(1)
|
1 / 0 |
| O94956 | Solute carrier organic anion transporter family member 2B1 | Unclassified protein | CHEMBL446299 |
CHEMBL2169431
(1)
|
0 / 0 |
| Q9NPD5 | Solute carrier organic anion transporter family member 1B3 | Electrochemical transporter | CHEMBL446299 |
CHEMBL2169430
(1)
|
1 / 0 |
| P33261 | Cytochrome P450 2C19 | Cytochrome P450 2C19 | CHEMBL446299 |
CHEMBL1743279
(1)
|
1 / 1 |