KNApSAcK Metabolite C00045242
Metabolite
KNApSAcK Entry
| id | C00045242 |
|---|---|
| Name | Bryonioside A / (+)-Bryonioside A |
| CAS RN | 405281-89-2 |
| Standard InChI | InChI=1S/C36H60O9/c1-19(9-13-26(39)33(4,5)45-31-30(43)29(42)28(41)23(18-37)44-31)20-15-16-34(6)24-12-10-21-22(11-14-25(38)32(21,2)3)36(24,8)27(40)17-35(20,34)7/h10,19-20,22-26,28-31,37-39,41-43H,9,11-18H2,1-8H3/t19-,20-,22-,23-,24+,25+,26-,28-,29+,30-,31+,34+,35-,36+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C36H60O9/c1-19(9-13-26(39)33(4,5)45-31-30(43)29(42)28(41)23(18-37)44-31)20-15-16-34(6)24-12-10-21-22(11-14-25(38)32(21,2)3)36(24,8)27(40)17-35(20,34)7/h10,19-20,22-26,28-31,37-39,41-43H,9,11-18H2,1-8H3 |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 202 |
Link
ChEMBL
| By standard InChI | CHEMBL450045 |
|---|---|
| By standard InChI Main Layer | CHEMBL450045 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Cucurbitaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Bryonia dioica | 3652 | Cucurbitaceae | rosids | Viridiplantae |