| CAS ID: | 80418-24-2 |
| Molecular Formula: | C47H80O18 |
| Molecular Weight: | 933.1 g/mol |
| Monoisotopic Mass: | 932.5345 g/mol |
| Class: | Small Molecule |
| Natural Product: | Yes |
| Other Names: | Notoginsenoside R1 | Notoginsenoside-R1 |
| Analysis: | Drug repositioning mechanism analysis |
| InChI: | InChI=1S/C47H80O18/c1-21(2)10-9-13-47(8,65-41-37(59)34(56)32(54)26(18-48)62-41)22-11-15-45(6)30(22)23(50)16-28-44(5)14-12-29(52)43(3,4)39(44)25(17-46(28,45)7)61-42-38(35(57)33(55)27(19-49)63-42)64-40-36(58)31(53)24(51)20-60-40/h10,22-42,48-59H,9,11-20H2,1-8H3/t22-,23+,24+,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36+,37+,38+,39-,40-,41-,42+,44+,45+,46+,47-/m0/s1 | See All |
| InChI Key: | LLPWNQMSUYAGQI-OOSPGMBYSA-N | |
| Smiles: | CC(=CCC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]2CC[C@]3(C)[C@@H]2[C@H](O)C[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5[C@H](C[C@@]34C)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)C | See All |
| Molfile: | Download |
Reference Record 1
| PubMed ID | 28017695 | Target ID | |
| Uniprot ID | Name | ||
| Model | mice | Fibrosis Disease | Cardiac fibrosis |
| Process I | |||
| Process II | |||
| Process III | prevenet collagen deposition | ||
| Mechanism | Targeting miR-29c | ||
| PubChem: | 441934 |
| ChEMBL: | CHEMBL507115 |