CAS ID: | 630-60-4 |
Molecular Formula: | C29H44O12 |
Molecular Weight: | 584.7 g/mol |
Monoisotopic Mass: | 584.2833 g/mol |
Class: | Small Molecule |
Natural Product: | No |
Other Names: | G-STROPHANTHIN | OUABAINE ARNAUD | STRODIVAL | NSC-25485 | OUABAIN |
Analysis: | Drug repositioning mechanism analysis |
InChI: | InChI=1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1 | See All |
InChI Key: | LPMXVESGRSUGHW-HBYQJFLCSA-N | |
Smiles: | C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C6=CC(=O)OC6)[C@H](O)[C@H](O)[C@H]1O | See All |
Molfile: | Download |
Reference Record 1
PubMed ID | 27217195 | Target ID | |
Uniprot ID | Name | ||
Model | vitro,rat | Fibrosis Disease | Renal fibrosis |
Process I | |||
Process II | |||
Process III | prevenet collagen deposition | ||
Mechanism |
PubChem: | 439501 |
ChEMBL: | CHEMBL222863 |