3,5,19-Trihydroxy-8,19-epoxycard-20(22)-enolide
3-[(1S,5R,6S,13S,15S)-13,15,18-trihydroxy-5-methyl-19-oxapentacyclo[8.7.2.01,13.02,10.05,9]nonadecan-6-yl]-2H-furan-5-one
Also Known As: Pseudostrophanthidin|AC1L1PSQ|3,5,19-Trihydroxy-8,19-epoxycard-20(22)-enolide|8,19-Epoxy-3-beta,5,19-trihydroxy-5-beta-card-20(22)-enolide|5-beta-CARD-20(22)-ENOLIDE, 8,19-EPOXY-3-beta,5,19-TRIHYDROXY-|Card-20(22)-enolide, 8,19-epoxy-3,5,19-trihydroxy-, (3-beta,5-beta)-|(8xi,9xi,14xi)-3beta,5,19-Trihydroxy-5beta-8,19-epoxycard-20(22)-enolide|Card-20(22)-enolide, 8,19-epoxy-3,5,19-trihydroxy-, (3-beta,5-beta)- (9CI)
| Molecular Formula | C23H32O6 |
|---|---|
| Molecular Weight | 404.21988 g/mol |
| LogP | 2.06 |
| Topological Polar Surface Area | 96.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 404.21988 |
| Heavy Atoms | 29 |
| Complexity | 794.2 |
Chemical Identifiers
| CAS Number | 26543-54-4 |
|---|---|
| SMILES | C[C@]12CCC3[C@@]45CC[C@@H](C[C@]4(CCC3(C1CC[C@@H]2C6=CC(=O)OC6)OC5O)O)O |
Product Overview
3,5,19-Trihydroxy-8,19-epoxycard-20(22)-enolide (CAS 26543-54-4), with molecular formula C23H32O6 and molecular weight 404.21988 g/mol. IUPAC: 3-[(1S,5R,6S,13S,15S)-13,15,18-trihydroxy-5-methyl-19-oxapentacyclo[8.7.2.01,13.02,10.05,9]nonadecan-6-yl]-2H-furan-5-one.
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