Isosteviol
(1R,4S,5R,9S,10R,13S)-5,9,13-trimethyl-14-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Also Known As: Isosteviol|iso-steviol|(-)-Isosteviol|Ketoisostevic Acid|Isosteriol|Isosteviol (Standard)|ent-16-ketobeyeran-19-oic acid|(-)-Isosteviol;iso-Steviol|16-oxobeyeran-18-oic acid|STX-03|HY-N0872R|HY-N0872|3749AH|NP1538|s3905|CS-3919
| Molecular Formula | C20H30O3 |
|---|---|
| Molecular Weight | 318.21948 g/mol |
| LogP | 4.44 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.21948 |
| Heavy Atoms | 23 |
| Complexity | 583.4 |
Chemical Identifiers
| CAS Number | 27975-19-5 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@@]4(CCC[C@@]([C@H]4CC[C@@]3(C1)CC2=O)(C)C(=O)O)C |
Product Overview
Isosteviol (CAS 27975-19-5), with molecular formula C20H30O3 and molecular weight 318.21948 g/mol. IUPAC: (1R,4S,5R,9S,10R,13S)-5,9,13-trimethyl-14-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid.
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