KNApSAcK Metabolite C00005627
Metabolite
KNApSAcK Entry
| id | C00005627 |
|---|---|
| Name | 3,7,2',3',4'-Pentahydroxyflavone 3-neohesperidoside |
| CAS RN | 83841-48-9 |
| Standard InChI | InChI=1S/C27H30O16/c1-8-15(31)20(36)22(38)26(39-8)43-25-21(37)19(35)14(7-28)41-27(25)42-24-17(33)10-3-2-9(29)6-13(10)40-23(24)11-4-5-12(30)18(34)16(11)32/h2-6,8,14-15,19-22,25-32,34-38H,7H2,1H3/t8?,14?,15-,19+,20?,21?,22-,25?,26-,27-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H30O16/c1-8-15(31)20(36)22(38)26(39-8)43-25-21(37)19(35)14(7-28)41-27(25)42-24-17(33)10-3-2-9(29)6-13(10)40-23(24)11-4-5-12(30)18(34)16(11)32/h2-6,8,14-15,19-22,25-32,34-38H,7H2,1H3 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 1 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Bignoniaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Jacaranda acutifolia | 83946 | Bignoniaceae | asterids | Viridiplantae |