KNApSAcK Metabolite C00033299
Metabolite
KNApSAcK Entry
| id | C00033299 |
|---|---|
| Name | Phytolaccoside E |
| CAS RN | 65497-07-6 |
| Standard InChI | InChI=1S/C42H66O16/c1-37(36(53)54-6)11-13-42(35(51)52)14-12-40(4)20(21(42)15-37)7-8-26-38(2)16-22(45)32(39(3,19-44)25(38)9-10-41(26,40)5)58-33-30(49)28(47)24(18-55-33)57-34-31(50)29(48)27(46)23(17-43)56-34/h7,21-34,43-50H,8-19H2,1-6H3,(H,51,52)/t21-,22-,23+,24+,25+,26+,27+,28-,29-,30+,31+,32-,33-,34-,37-,38-,39-,40+,41+,42-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C42H66O16/c1-37(36(53)54-6)11-13-42(35(51)52)14-12-40(4)20(21(42)15-37)7-8-26-38(2)16-22(45)32(39(3,19-44)25(38)9-10-41(26,40)5)58-33-30(49)28(47)24(18-55-33)57-34-31(50)29(48)27(46)23(17-43)56-34/h7,21-34,43-50H,8-19H2,1-6H3,(H,51,52) |
Cluster
| Phytochemical cluster | No. 51 |
|---|---|
| KCF-S cluster | No. 9 |
Link
ChEMBL
| By standard InChI | CHEMBL237885 |
|---|---|
| By standard InChI Main Layer | CHEMBL237885 CHEMBL404391 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN | C076297 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 2 |
Family
| family name | count |
|---|---|
| Phytolaccaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Phytolacca americana | 3527 | Phytolaccaceae | eudicotyledons | Viridiplantae |
| Phytolacca tetramera Hauman | 3526 | Phytolaccaceae | eudicotyledons | Viridiplantae |
Human Protein / Gene in interaction
2 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P35354 | Prostaglandin G/H synthase 2 | Oxidoreductase | CHEMBL237885 |
CHEMBL901504
(1)
|
0 / 3 |
| P08183 | Multidrug resistance protein 1 | drug | CHEMBL404391 |
CHEMBL923458
(1)
CHEMBL923459
(1)
CHEMBL923460 (1) |
1 / 0 |