KNApSAcK Metabolite C00035129
Metabolite
KNApSAcK Entry
| id | C00035129 |
|---|---|
| Name | Methyl angolensate |
| CAS RN | 2629-14-3 |
| Standard InChI | InChI=1S/C27H34O7/c1-15-17-7-9-25(4)23(16-8-10-32-14-16)33-22(30)13-27(15,25)34-20-12-19(28)24(2,3)18(26(17,20)5)11-21(29)31-6/h8,10,14,17-18,20,23H,1,7,9,11-13H2,2-6H3/t17-,18-,20-,23-,25-,26+,27-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H34O7/c1-15-17-7-9-25(4)23(16-8-10-32-14-16)33-22(30)13-27(15,25)34-20-12-19(28)24(2,3)18(26(17,20)5)11-21(29)31-6/h8,10,14,17-18,20,23H,1,7,9,11-13H2,2-6H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1249 |
Link
ChEMBL
| By standard InChI | CHEMBL483006 |
|---|---|
| By standard InChI Main Layer | CHEMBL483006 CHEMBL1170283 CHEMBL1450493 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C092741 |
|---|
Species
Summary
List (3)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Khaya anthotheca | 124953 | Meliaceae | rosids | Viridiplantae |
| Lansium domesticum Corr. | 201016 | Meliaceae | rosids | Viridiplantae |
| Swietenia mahagoni | 459165 | Meliaceae | rosids | Viridiplantae |
Human Protein / Gene in interaction
1 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P08684 | Cytochrome P450 3A4 | Cytochrome P450 3A4 | CHEMBL1450493 |
CHEMBL1614108
(1)
CHEMBL1613886
(1)
|
0 / 1 |