KNApSAcK Metabolite C00006814
Metabolite
KNApSAcK Entry
| id | C00006814 |
|---|---|
| Name | Cyanidin 3-(6''-acetylglucoside)-5-glucoside |
| CAS RN | 133179-76-7 |
| Standard InChI | InChI=1S/C29H32O17/c1-10(31)41-9-20-22(36)24(38)26(40)29(46-20)44-18-7-13-16(42-27(18)11-2-3-14(33)15(34)4-11)5-12(32)6-17(13)43-28-25(39)23(37)21(35)19(8-30)45-28/h2-7,19-26,28-30,35-40H,8-9H2,1H3,(H2-,32,33,34)/p+1/t19?,20?,21-,22-,23+,24?,25?,26?,28-,29-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C29H32O17/c1-10(31)41-9-20-22(36)24(38)26(40)29(46-20)44-18-7-13-16(42-27(18)11-2-3-14(33)15(34)4-11)5-12(32)6-17(13)43-28-25(39)23(37)21(35)19(8-30)45-28/h2-7,19-26,28-30,35-40H,8-9H2,1H3,(H2-,32,33,34) |
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 |
|---|---|
| Verbenaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Verbena x hybrida | 76714 | Verbenaceae | asterids | Viridiplantae |