KNApSAcK Metabolite C00011076
Metabolite
KNApSAcK Entry
| id | C00011076 |
|---|---|
| Name | Pelargonidin 3-[2''-(2'''-trans-caffeoyl-beta-D-glucopyranosyl)-beta-D-galactopyranoside] |
| CAS RN | 202338-37-2 |
| Standard InChI | InChI=1S/C36H36O18/c37-13-25-29(46)31(48)34(35(51-25)50-24-12-19-21(42)10-18(40)11-23(19)49-32(24)16-3-5-17(39)6-4-16)54-36-33(30(47)28(45)26(14-38)52-36)53-27(44)8-2-15-1-7-20(41)22(43)9-15/h1-12,25-26,28-31,33-38,45-48H,13-14H2,(H4-,39,40,41,42,43,44)/p+1/t25?,26-,28-,29+,30?,31+,33?,34?,35-,36+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C36H36O18/c37-13-25-29(46)31(48)34(35(51-25)50-24-12-19-21(42)10-18(40)11-23(19)49-32(24)16-3-5-17(39)6-4-16)54-36-33(30(47)28(45)26(14-38)52-36)53-27(44)8-2-15-1-7-20(41)22(43)9-15/h1-12,25-26,28-31,33-38,45-48H,13-14H2,(H4-,39,40,41,42,43,44) |
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 |
|---|---|
| eudicotyledons | 1 |
Family
| family name | count |
|---|---|
| Ranunculaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Pulsatilla cernua | 231674 | Ranunculaceae | eudicotyledons | Viridiplantae |