KNApSAcK Metabolite C00013793
Metabolite
KNApSAcK Entry
| id | C00013793 |
|---|---|
| Name | Kaempferol 3-[2Gal-(6'''-feruloylglucosyl)-robinobioside] / 3-[[O-6-deoxy-alpha-L-mannopyranosyl-(1->6)-O-[6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl-(1->2)]-beta-D-galactopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one |
| CAS RN | 260388-56-5 |
| Standard InChI | InChI=1S/C43H48O23/c1-16-29(49)33(53)36(56)41(61-16)60-15-26-31(51)35(55)40(43(64-26)65-39-32(52)28-22(47)12-20(45)13-24(28)62-38(39)18-5-7-19(44)8-6-18)66-42-37(57)34(54)30(50)25(63-42)14-59-27(48)10-4-17-3-9-21(46)23(11-17)58-2/h3-13,16,25-26,29-31,33-37,40-47,49-51,53-57H,14-15H2,1-2H3/b10-4+/t16?,25-,26-,29+,30-,31+,33?,34?,35?,36+,37?,40?,41-,42+,43+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C43H48O23/c1-16-29(49)33(53)36(56)41(61-16)60-15-26-31(51)35(55)40(43(64-26)65-39-32(52)28-22(47)12-20(45)13-24(28)62-38(39)18-5-7-19(44)8-6-18)66-42-37(57)34(54)30(50)25(63-42)14-59-27(48)10-4-17-3-9-21(46)23(11-17)58-2/h3-13,16,25-26,29-31,33-37,40-47,49-51,53-57H,14-15H2,1-2H3 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 7 |
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 |
|---|---|
| Solanaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Brunfelsia grandiflora | 1035550 | Solanaceae | asterids | Viridiplantae |