KNApSAcK Metabolite C00003607
Metabolite
KNApSAcK Entry
| id | C00003607 |
|---|---|
| Name | Bryotoxin A |
| CAS RN | 101329-50-4 |
| Standard InChI | InChI=1S/C32H42O12/c1-16-12-22(43-17(2)34)25(36)28(42-16)44-19-6-9-30(15-33)24-21(7-10-31(30,39)13-19)32(40)11-8-20(18-4-5-23(35)41-14-18)29(32,3)27(38)26(24)37/h4-5,14-16,19-22,24-26,28,36-37,39-40H,6-13H2,1-3H3/t16?,19-,20+,21+,22-,24+,25?,26-,28-,29-,30-,31-,32-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C32H42O12/c1-16-12-22(43-17(2)34)25(36)28(42-16)44-19-6-9-30(15-33)24-21(7-10-31(30,39)13-19)32(40)11-8-20(18-4-5-23(35)41-14-18)29(32,3)27(38)26(24)37/h4-5,14-16,19-22,24-26,28,36-37,39-40H,6-13H2,1-3H3 |
Cluster
| Phytochemical cluster | No. 57 |
|---|---|
| KCF-S cluster | No. 698 |
Link
ChEMBL
| By standard InChI | |
|---|---|
| By standard InChI Main Layer |
KEGG
| By LinkDB | C08853 |
|---|
CTD
| By CAS RN | C062709 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 1 |
Family
| family name | count |
|---|---|
| Crassulaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Bryophyllum tubiflorum | 84209 | Crassulaceae | eudicotyledons | Viridiplantae |