KNApSAcK Metabolite C00006722
Metabolite
KNApSAcK Entry
| id | C00006722 |
|---|---|
| Name | Petunidin 3-glucoside / Petunidin 3-O-beta-D-glucopyranoside |
| CAS RN | 6988-81-4 |
| Standard InChI | InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/p+1/t16?,18-,19?,20?,22-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27) |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 2 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer | CHEMBL1784264 |
KEGG
| By LinkDB | C12139 |
|---|
CTD
| By CAS RN | C455107 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 14 |
| asterids | 6 |
| Spermatophyta | 5 |
| eudicotyledons | 3 |
| Liliopsida | 3 |
Family (Top 10)
| family name | count |
|---|---|
| Fabaceae | 7 |
| Pinaceae | 5 |
| Ericaceae | 4 |
| Myrtaceae | 2 |
| Anacardiaceae | 2 |
| Berberidaceae | 2 |
| Hyacinthaceae | 1 |
| Zingiberaceae | 1 |
| Passifloraceae | 1 |
| Lythraceae | 1 |