CAS | 681457-46-5 |
Synonyms | Britannilactone 1-O-acetate |
IUPAC Name | 4-[(3aS,4R,7aR)-4-hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-5-yl]pentyl acetate |
Molecular Weight | 308.37 |
Molecular Formula | C17H24O5 |
Canonical SMILES | CC1=C([C@@H]([C@H]2[C@@H](C1)OC(=O)C2=C)O)C(C)CCCOC(=O)C |
InChI | InChI=1S/C17H24O5/c1-9(6-5-7-21-12(4)18)14-10(2)8-13-15(16(14)19)11(3)17(20)22-13/h9,13,15-16,19H,3,5-8H2,1-2,4H3/t9?,13-,15-,16+/m1/s1 |
InChI Key | QKUFZFLZBUSEHN-MCJOIMHTSA-N |
Purity | 98% |
Density | 1.16 g/ml |
Appearance | Solid |
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