Glaucolide B
[(1S,2R,4R,8R,10S)-8,10-diacetyloxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-11-en-12-yl]methyl acetate
Also Known As: Glaucolide B|((1S,2R,4R,8R,10S)-8,10-diacetyloxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo(9.3.0.02,4)tetradec-11-en-12-yl)methyl acetate|(1aR,5R,7S,10aS,10bR)-8-[(Acetyloxy)methyl]-1a,5-dimethyl-4,9-dioxo-1a,2,3,4,5,6,7,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-5,7-diyl diacetate|[(1S,2R,4R,8R,10S)-8,10-diacetyloxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-11-en-12-yl]methyl acetate|8-[(Acetyloxy)methyl]-1a,5-dimethyl-4,9-dioxo-1a,2,3,4,5,6,7,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-5,7-diyl diacetate|Acetic acid (1S,2R,4R,8R,10S)-8-acetoxy-12-acetoxymethyl-4,8-dimethyl-7,13-dioxo-3,14-dioxa-tricyclo[9.3.0.02,4]tetradec-11-en-10-yl ester|methyl (2S,3R,4S)-4-(((1R)-2-acetyl-6,7-dihydroxy-3,4-dihydro-1H-isoquinolin-1-yl)methyl)-2-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl)oxy-3-vinyl-3,4-dihydro-2H-pyran-5-carboxylate
| Molecular Formula | C21H26O10 |
|---|---|
| Molecular Weight | 438.1526 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.1526 |
| Monoisotopic Mass | 438.1526 |
| Heavy Atoms | 31 |
| Complexity | 873.0 |
Chemical Identifiers
| CAS Number | 11091-27-3 |
|---|---|
| SMILES | CC(=O)OCC1=C2[C@H](C[C@@](C(=O)CC[C@@]3([C@@H]([C@H]2OC1=O)O3)C)(C)OC(=O)C)OC(=O)C |
| InChIKey | JNLNEIIZZQABDP-ZBWGKUOUSA-N |
Product Overview
Glaucolide B (CAS 11091-27-3), with molecular formula C21H26O10 and molecular weight 438.1526 g/mol. IUPAC: [(1S,2R,4R,8R,10S)-8,10-diacetyloxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.02,4]tetradec-11-en-12-yl]methyl acetate.
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