13-Hydroxy-15-oxokaur-16-en-18-oic acid
(1S,5R,9R,13R)-13-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Also Known As: 15-Oxosteviol|AC1L1SMT|CCRIS 1512|BRN 4267350|13-Hydroxy-15-oxokaur-16-en-18-oic acid|(4-alpha)-13-Hydroxy-15-oxo-kaur-16-en-18-oic acid|(5xi,9xi)-13-hydroxy-15-oxokaur-16-en-18-oic acid|KAUR-16-EN-18-OIC ACID, 13-HYDROXY-15-OXO-, (4-alpha)-|(1S,5R,9R,13R)-13-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
| Molecular Formula | C20H28O4 |
|---|---|
| Molecular Weight | 332.19876 g/mol |
| LogP | 3.33 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.19876 |
| Heavy Atoms | 24 |
| Complexity | 654.0 |
Chemical Identifiers
| CAS Number | 106428-28-8 |
|---|---|
| SMILES | C[C@]12CCC[C@@](C1CC[C@@]34C2CC[C@@](C3)(C(=C)C4=O)O)(C)C(=O)O |
Product Overview
13-Hydroxy-15-oxokaur-16-en-18-oic acid (CAS 106428-28-8), with molecular formula C20H28O4 and molecular weight 332.19876 g/mol. IUPAC: (1S,5R,9R,13R)-13-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid.
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