Echinone
[(1S)-1-(4-hydroxy-1-methoxy-5,8-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate
Also Known As: Echinone|(-)-Echinone|[(1S)-1-(4-hydroxy-1-methoxy-5,8-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate|1,4-Naphthalenedione, 6-((1S)-1-(acetyloxy)-4-methyl-3-pentenyl)-8-hydroxy-5-methoxy-|(1S)-1-(4-hydroxy-1-methoxy-5,8-dioxo-5,8-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl acetate|(-)-6-[(S)-1-Acetoxy-4-methyl-3-pentenyl]-8-hydroxy-5-methoxy-1,4-naphthalenedione|-6-[ -1-Acetoxy-4-methyl-3-pentenyl]-8-hydroxy-5-methoxy-1,4-naphthalenedione|[(1S)-1-(4-hydroxy-1-methoxy-5,8-dioxo-2-naphthyl)-4-methyl-pent-3-enyl] acetate|6-((1S)-1-(Acetyloxy)-4-methyl-3-pentenyl)-8-hydroxy-5-methoxy-1,4-naphthalenedione
| Molecular Formula | C19H20O6 |
|---|---|
| Molecular Weight | 344.12598 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.12598 |
| Monoisotopic Mass | 344.12598 |
| Heavy Atoms | 25 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 80348-65-8 |
|---|---|
| SMILES | CC(=CC[C@@H](C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)O)OC(=O)C)C |
| InChIKey | SCIUCADXFKAPEB-INIZCTEOSA-N |
Product Overview
Echinone (CAS 80348-65-8), with molecular formula C19H20O6 and molecular weight 344.12598 g/mol. IUPAC: [(1S)-1-(4-hydroxy-1-methoxy-5,8-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate.