AU1MEC3WBR
(Z)-7-[(1S,2R,3S,4R)-3-[(E)-3-hydroxy-4-phenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid
Also Known As: SQ 28668|(Z)-7-[(1S,2R,3S,4R)-3-[(E)-3-hydroxy-4-phenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid|5-Heptenoic acid, 7-(3-(3-hydroxy-4-phenyl-1-pentenyl)-7-oxabicyclo(2.2.1)hept-2-yl)-, (1alpha,2alpha(Z),3alpha(1E,3S*,4R*),4alpha)-
CAS: 87983-63-9
| Molecular Formula | C24H32O4 |
|---|---|
| Molecular Weight | 384.23007 g/mol |
| LogP | 4.702 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 384.23007 |
| Monoisotopic Mass | 384.23007 |
| Heavy Atoms | 28 |
| Complexity | 681.1054 |
Chemical Identifiers
| CAS Number | 87983-63-9 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)C(/C=C/[C@@H]2[C@H]3CC[C@@H]([C@@H]2C/C=C\CCCC(=O)O)O3)O |
Product Overview
AU1MEC3WBR (CAS 87983-63-9), with molecular formula C24H32O4 and molecular weight 384.23007 g/mol. IUPAC: (Z)-7-[(1S,2R,3S,4R)-3-[(E)-3-hydroxy-4-phenylpent-1-enyl]-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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