KNApSAcK Metabolite C00013893
Metabolite
KNApSAcK Entry
| id | C00013893 |
|---|---|
| Name | Quercetin 3-rhamnosyl-(1->6)-[rhamnosyl-(1->2)-(3''-(E)-p-coumaroylgalactoside)]-7-rhamnoside / 3-[[O-6-Deoxy-alpha-L-mannopyranosyl-(1->2)-O-[6-deoxy-alpha-L-mannopyranosyl-(1->6)]-3-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-galactopyranosyl]oxy]-7-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-4H-1-benzopyran-4-one |
| CAS RN | 412929-24-9 |
| Standard InChI | InChI=1S/C48H56O26/c1-16-30(54)35(59)38(62)45(66-16)65-15-27-33(57)42(72-28(53)11-6-19-4-8-21(49)9-5-19)44(74-47-40(64)37(61)32(56)18(3)68-47)48(71-27)73-43-34(58)29-25(52)13-22(69-46-39(63)36(60)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-33,35-40,42,44-52,54-57,59-64H,15H2,1-3H3/b11-6+/t16?,17?,18?,27?,30-,31-,32-,33-,35?,36?,37?,38-,39-,40-,42-,44?,45+,46-,47-,48-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C48H56O26/c1-16-30(54)35(59)38(62)45(66-16)65-15-27-33(57)42(72-28(53)11-6-19-4-8-21(49)9-5-19)44(74-47-40(64)37(61)32(56)18(3)68-47)48(71-27)73-43-34(58)29-25(52)13-22(69-46-39(63)36(60)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-33,35-40,42,44-52,54-57,59-64H,15H2,1-3H3 |
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 |
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Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Apocynaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Rhazya orientalis | 141609 | Apocynaceae | asterids | Viridiplantae |