KNApSAcK Metabolite C00013891
Metabolite
KNApSAcK Entry
| id | C00013891 |
|---|---|
| Name | Quercetin 3-(6''-(E)-sinapoylsophoroside)-7-rhamnoside / 7-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-3-[[2-O-[6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one |
| CAS RN | 404843-89-6 |
| Standard InChI | InChI=1S/C44H50O25/c1-15-29(50)34(55)37(58)42(63-15)64-18-11-21(48)28-22(12-18)65-39(17-5-6-19(46)20(47)10-17)40(33(28)54)68-44-41(36(57)31(52)25(13-45)66-44)69-43-38(59)35(56)32(53)26(67-43)14-62-27(49)7-4-16-8-23(60-2)30(51)24(9-16)61-3/h4-12,15,25-26,29,31-32,34-38,41-48,50-53,55-59H,13-14H2,1-3H3/b7-4+/t15?,25?,26?,29-,31+,32+,34?,35-,36-,37-,38?,41?,42-,43-,44-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C44H50O25/c1-15-29(50)34(55)37(58)42(63-15)64-18-11-21(48)28-22(12-18)65-39(17-5-6-19(46)20(47)10-17)40(33(28)54)68-44-41(36(57)31(52)25(13-45)66-44)69-43-38(59)35(56)32(53)26(67-43)14-62-27(49)7-4-16-8-23(60-2)30(51)24(9-16)61-3/h4-12,15,25-26,29,31-32,34-38,41-48,50-53,55-59H,13-14H2,1-3H3 |
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 |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Elaeagnaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Elaeagnus bockii | 193514 | Elaeagnaceae | rosids | Viridiplantae |