KNApSAcK Metabolite C00042100
Metabolite
KNApSAcK Entry
| id | C00042100 |
|---|---|
| Name | 3',4',4a',9a'-Tetrahydro-6,7'-dimethylspiro[benzofuran-3(2H),2'-pyrano[2,3-b]benzofuran]-2,4a',diol |
| CAS RN | 223680-32-8 |
| Standard InChI | InChI=1S/C20H20O5/c1-11-3-5-13-15(9-11)24-18-19(13,22)7-8-20(25-18)14-6-4-12(2)10-16(14)23-17(20)21/h3-6,9-10,17-18,21-22H,7-8H2,1-2H3/t17-,18-,19+,20-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C20H20O5/c1-11-3-5-13-15(9-11)24-18-19(13,22)7-8-20(25-18)14-6-4-12(2)10-16(14)23-17(20)21/h3-6,9-10,17-18,21-22H,7-8H2,1-2H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 8109 |
Link
ChEMBL
| By standard InChI | CHEMBL486806 |
|---|---|
| By standard InChI Main Layer | CHEMBL486806 CHEMBL1795998 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Asteraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Hofmeisteria schaffneri | 176606 | Asteraceae | asterids | Viridiplantae |