KNApSAcK Metabolite C00005960
Metabolite
KNApSAcK Entry
| id | C00005960 |
|---|---|
| Name | Quercetin 3-(3''-p-coumarylglucoside) |
| CAS RN | 70286-61-2 / 67214-04-4 |
| Standard InChI | InChI=1S/C30H26O14/c31-12-21-24(38)28(43-22(37)8-3-13-1-5-15(32)6-2-13)26(40)30(42-21)44-29-25(39)23-19(36)10-16(33)11-20(23)41-27(29)14-4-7-17(34)18(35)9-14/h1-11,21,24,26,28,30-36,38,40H,12H2/b8-3+/t21?,24-,26-,28?,30+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C30H26O14/c31-12-21-24(38)28(43-22(37)8-3-13-1-5-15(32)6-2-13)26(40)30(42-21)44-29-25(39)23-19(36)10-16(33)11-20(23)41-27(29)14-4-7-17(34)18(35)9-14/h1-11,21,24,26,28,30-36,38,40H,12H2 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 30 |
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 |
|---|---|
| Spermatophyta | 2 |
Family
| family name | count |
|---|---|
| Pinaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Pinus contorta | 3339 | Pinaceae | Spermatophyta | Viridiplantae |
| Pinus sylvestris | 3349 | Pinaceae | Spermatophyta | Viridiplantae |