KNApSAcK Metabolite C00004205
Metabolite
KNApSAcK Entry
| id | C00004205 |
|---|---|
| Name | Linarin / Buddleoflavonoloside / Acacetin 7-rutinoside / Acacetin 7-O-rutinoside |
| CAS RN | 480-36-4 |
| Standard InChI | InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11?,19?,21-,22+,23-,24-,25?,26?,27+,28+/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 1 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL447738 CHEMBL509502 CHEMBL601333 CHEMBL1357379 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C008282 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 4 |
Family
| family name | count |
|---|---|
| Lamiaceae | 2 |
| Plantaginaceae | 1 |
| Asteraceae | 1 |
List (5)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Cirsium arvense | 41550 | Asteraceae | asterids | Viridiplantae |
| Linaria vulgaris | 43171 | Plantaginaceae | asterids | Viridiplantae |
| Melandrum firmum | ||||
| Mentha aquatica L. | 190902 | Lamiaceae | asterids | Viridiplantae |
| Teucridium parvifolium | 54474 | Lamiaceae | asterids | Viridiplantae |
Human Protein / Gene in interaction
1 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P15428 | 15-hydroxyprostaglandin dehydrogenase [NAD(+)] | Enzyme | CHEMBL1357379 |
CHEMBL1614038
(1)
|
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