| CAS ID: | 401519-96-8 |
| Molecular Formula: | C38H55NO10 |
| Molecular Weight: | 685.9 g/mol |
| Monoisotopic Mass: | 685.383 g/mol |
| Class: | Small Molecule |
| Natural Product: | No |
| Other Names: | |
| Analysis: | Drug repositioning mechanism analysis |
| InChI: | InChI=1S/C38H55NO10/c1-24(28-10-11-29-36-30(16-18-38(28,29)3)37(2)17-15-27(40)22-26(37)23-31(36)41)7-13-35(43)49-32-12-8-25(21-33(32)46-4)9-14-34(42)47-19-5-6-20-48-39(44)45/h8-9,12,14,21,24,26-31,36,40-41H,5-7,10-11,13,15-20,22-23H2,1-4H3/b14-9+/t24-,26+,27-,28-,29+,30?,31+,36+,37+,38-/m1/s1 | See All |
| InChI Key: | WTAVOESJEWSDJC-YPNWUOBLSA-N | |
| Smiles: | CC(CCC(=O)OC1=C(C=C(C=C1)C=CC(=O)OCCCCO[N+](=O)[O-])OC)C2CCC3C2(CCC4C3C(CC5C4(CCC(C5)O)C)O)C | See All |
| Molfile: |
Trial Record 1
| ClinicalTrial ID | NCT00414869 | Disease | Fibrosis |
| Phase | Phase 2 | Status | Terminated |
| First Received | December 22, 2006 | Last Verified | February 9, 2017 |
| Sponsor | Forest Laboratories | ||
| PubChem: | 9874758 |
| ChEMBL: |