KNApSAcK Metabolite C00010173
Metabolite
KNApSAcK Entry
| id | C00010173 |
|---|---|
| Name | 4'-O-Methylneobavaisoflavone 7-O-(2''-p-coumaroylglucoside) |
| CAS RN | 126654-66-8 |
| Standard InChI | InChI=1S/C36H36O11/c1-20(2)4-8-23-16-22(9-14-28(23)43-3)27-19-44-29-17-25(12-13-26(29)32(27)40)45-36-35(34(42)33(41)30(18-37)46-36)47-31(39)15-7-21-5-10-24(38)11-6-21/h4-7,9-17,19,30,33-38,41-42H,8,18H2,1-3H3/b15-7+/t30?,33-,34+,35?,36-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C36H36O11/c1-20(2)4-8-23-16-22(9-14-28(23)43-3)27-19-44-29-17-25(12-13-26(29)32(27)40)45-36-35(34(42)33(41)30(18-37)46-36)47-31(39)15-7-21-5-10-24(38)11-6-21/h4-7,9-17,19,30,33-38,41-42H,8,18H2,1-3H3 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 30 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL453212 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C064335 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Orobanchaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Sopubia delphinifolia | 46045 | Orobanchaceae | asterids | Viridiplantae |