Bipindosid [German]
3-[(3S,5S,10R,11R,13R,14S,17R)-5,11,14-trihydroxy-10,13-dimethyl-3-[(2S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Bipindoside, Bipindosid, Bipindosid [German], Bipindogenin-L-talomethylosid, Bipindogenin-L-talomethylosid [German], 3-beta-((6-Deoxy-L-talopyranosyl)oxy)-5,11-alpha,14-trihydroxy-5-beta-card-20(22)-enolide, 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-L-talopyranosyl)oxy)-5,11-alpha,14-trihydroxy-
| Molecular Formula | C29H44O10 |
|---|---|
| Molecular Weight | 552.29346 g/mol |
| LogP | 0.54 |
| Topological Polar Surface Area | 166.14 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 552.29346 |
| Heavy Atoms | 39 |
| Complexity | 1033 |
Chemical Identifiers
| CAS Number | 6246-79-3 |
|---|---|
| SMILES | CC1[C@@H](C(C([C@H](O1)O[C@H]2CC[C@@]3(C4[C@@H](C[C@@]5([C@H](CC[C@@]5(C4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)O)C)O)O)O |
Product Overview
Bipindosid [German] (CAS 6246-79-3), with molecular formula C29H44O10 and molecular weight 552.29346 g/mol. IUPAC: 3-[(3S,5S,10R,11R,13R,14S,17R)-5,11,14-trihydroxy-10,13-dimethyl-3-[(2S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
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