KNApSAcK Metabolite C00036896
Metabolite
KNApSAcK Entry
| id | C00036896 |
|---|---|
| Name | Silphioside A / Chikusetsusaponin IVa methyl ester |
| CAS RN | 58546-61-5 |
| Standard InChI | InChI=1S/C43H68O14/c1-38(2)15-17-43(37(52)57-35-31(49)28(46)27(45)23(20-44)54-35)18-16-41(6)21(22(43)19-38)9-10-25-40(5)13-12-26(39(3,4)24(40)11-14-42(25,41)7)55-36-32(50)29(47)30(48)33(56-36)34(51)53-8/h9,22-33,35-36,44-50H,10-20H2,1-8H3/t22-,23+,24-,25+,26-,27+,28-,29-,30-,31+,32+,33-,35-,36+,40-,41+,42+,43-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C43H68O14/c1-38(2)15-17-43(37(52)57-35-31(49)28(46)27(45)23(20-44)54-35)18-16-41(6)21(22(43)19-38)9-10-25-40(5)13-12-26(39(3,4)24(40)11-14-42(25,41)7)55-36-32(50)29(47)30(48)33(56-36)34(51)53-8/h9,22-33,35-36,44-50H,10-20H2,1-8H3 |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 9 |
Link
ChEMBL
| By standard InChI | CHEMBL1773984 |
|---|---|
| By standard InChI Main Layer | CHEMBL1773984 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| Liliopsida | 1 |
| asterids | 1 |
Family
| family name | count |
|---|---|
| Orchidaceae | 1 |
| Asteraceae | 1 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Brassia muricata | 125089 | Orchidaceae | Liliopsida | Viridiplantae |
| Silphium perfoliatum | 53588 | Asteraceae | asterids | Viridiplantae |