KNApSAcK Metabolite C00025624
Metabolite
KNApSAcK Entry
| id | C00025624 |
|---|---|
| Name | Repandin / Repandine / (-)-Repandine / N-Methyldemerarine |
| CAS RN | 518-92-3 |
| Standard InChI | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29-/m0/s1 |
| Standard InChI (Main Layer) | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3 |
Cluster
| Phytochemical cluster | No. 4 |
|---|---|
| KCF-S cluster | No. 10 |
Link
ChEMBL
| By standard InChI | CHEMBL510022 |
|---|---|
| By standard InChI Main Layer | CHEMBL510022 CHEMBL509999 CHEMBL1983122 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| eudicotyledons | 2 |
| Magnoliophyta | 2 |
Family
| family name | count |
|---|---|
| Menispermaceae | 2 |
| Atherospermataceae | 2 |
List (4)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Cyclea barbata Miers | 152373 | Menispermaceae | eudicotyledons | Viridiplantae |
| Cyclea peltata Diels | 152372 | Menispermaceae | eudicotyledons | Viridiplantae |
| Daphnandra dielsii | 74880 | Atherospermataceae | Magnoliophyta | Viridiplantae |
| Daphnandra repandura | 74880 | Atherospermataceae | Magnoliophyta | Viridiplantae |
Human Protein / Gene in interaction
5 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| Q99700 | Ataxin-2 | Unclassified protein | CHEMBL509999 |
CHEMBL2114784
(1)
|
1 / 1 |
| P84022 | Mothers against decapentaplegic homolog 3 | Unclassified protein | CHEMBL509999 |
CHEMBL1794584
(1)
|
2 / 0 |
| O75164 | Lysine-specific demethylase 4A | Enzyme | CHEMBL509999 |
CHEMBL1737991
(1)
|
0 / 0 |
| O75874 | Isocitrate dehydrogenase [NADP] cytoplasmic | Enzyme | CHEMBL509999 |
CHEMBL2354311
(1)
|
1 / 0 |
| P43351 | DNA repair protein RAD52 homolog | Unclassified protein | CHEMBL509999 |
CHEMBL2354285
(1)
|
0 / 0 |