Hyrtenone A
(1R,4S,6R,8R,13S,16S,21S)-8-hydroxy-6-methoxy-13,17,17,21-tetramethyl-5,12-dioxapentacyclo[11.8.0.03,11.04,8.016,21]henicosa-2,10-dien-9-one
Also Known As: Hyrtenone A|Aluminum,compd. with strontium (9:5)|J1.883.440E|rel-(2R,3aR,6aS,8aS,12aS,12bR,13bS)-3a-hydroxy-2-methoxy-6a,9,9,12a-tetramethyl-2,3,3a,6a,7,8,8a,9,10,11,12,12a,12b,13b-tetradecahydro-4H-benzo[a]furo[3,2-j]xanthen-4-one|(1R,4S,6R,8R,13S,16S,21S)-8-hydroxy-6-methoxy-13,17,17,21-tetramethyl-5,12-dioxapentacyclo[11.8.0.03,11.04,8.016,21]henicosa-2,10-dien-9-one|(2R,3aR,6aS,8aS,12aS,12bR,13bS)-3a-Hydroxy-2-methoxy-6a,9,9,12a-tetramethyl-2,3,3a,6a,7,8,8a,9,10,11,12,12a,12b,13b-tetradecahydro-4H-benzo[a]furo[3,2-j]xanthen-4-one|(4aS,14R)-11beta,10beta-(Epoxyethano)-1,2,3,4,4abeta,5,6,6a,10,11,12abeta,12b-dodecahydro-10-hydroxy-14-methoxy-4,4,6abeta,12balpha-tetramethyl-9H-benzo[a]xanthene-9-one|4H-benzo[a]furo[3,2-j]xanthen-4-one, 2,3,3a,6a,7,8,8a,9,10,11,12,12a,12b,13b-tetradecahydro-3a-hydroxy-2-methoxy-6a,9,9,12a-tetramethyl-, (2R,3aR,6aS,8aS,12aS,12bR,13bS)-
| Molecular Formula | C24H34O5 |
|---|---|
| Molecular Weight | 402.24063 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 402.24063 |
| Monoisotopic Mass | 402.24063 |
| Heavy Atoms | 29 |
| Complexity | 812.0 |
Chemical Identifiers
| CAS Number | 11-30-3 |
|---|---|
| SMILES | C[C@]12CCCC([C@@H]1CC[C@]3([C@@H]2C=C4[C@H]5[C@](C[C@@H](O5)OC)(C(=O)C=C4O3)O)C)(C)C |
| InChIKey | CMULOZRGTMXKCI-YIKRVMLOSA-N |
Product Overview
Hyrtenone A (CAS 11-30-3), with molecular formula C24H34O5 and molecular weight 402.24063 g/mol. IUPAC: (1R,4S,6R,8R,13S,16S,21S)-8-hydroxy-6-methoxy-13,17,17,21-tetramethyl-5,12-dioxapentacyclo[11.8.0.03,11.04,8.016,21]henicosa-2,10-dien-9-one.