KNApSAcK Metabolite C00011094
Metabolite
KNApSAcK Entry
| id | C00011094 |
|---|---|
| Name | 5-Carboxypyranocyanidin 3-O-(6''-O-malonyl-beta-glucopyranoside) |
| CAS RN | 566942-53-8 |
| Standard InChI | InChI=1S/C27H22O16/c28-10-4-14-20-11(6-16(40-14)26(37)38)25(24(41-15(20)5-10)9-1-2-12(29)13(30)3-9)43-27-23(36)22(35)21(34)17(42-27)8-39-19(33)7-18(31)32/h1-6,17,21-23,27,34-36H,7-8H2,(H4-,28,29,30,31,32,37,38)/p+1/t17-,21-,22?,23?,27+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C27H22O16/c28-10-4-14-20-11(6-16(40-14)26(37)38)25(24(41-15(20)5-10)9-1-2-12(29)13(30)3-9)43-27-23(36)22(35)21(34)17(42-27)8-39-19(33)7-18(31)32/h1-6,17,21-23,27,34-36H,7-8H2,(H4-,28,29,30,31,32,37,38) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1049 |
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 |
|---|---|
| Liliopsida | 1 |
Family
| family name | count |
|---|---|
| Amaryllidaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Allium cepa | 4679 | Amaryllidaceae | Liliopsida | Viridiplantae |