(3aS,4S,5R,6aS)-4-[(E,3S)-5-ethoxy-3-oxidanyl-pent-1-enyl]-2-methylidene-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one

Systemtic Name: (3aS,4S,5R,6aS)-4-[(E,3S)-5-ethoxy-3-oxidanyl-pent-1-enyl]-2-methylidene-5-oxidanyl-3,3a,4,5,6,6a-hexahydropentalen-1-one Openeye Name: (3aS,4S,5R,6aS)-4-[(E,3S)-5-ethoxy-3-hydroxy-pent-1-enyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one CAS Name: (3aS,4S,5R,6aS)-4-[(E,3S)-5-ethoxy-3-hydroxypent-1-enyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one IUPAC Name: (3aS,4S,5R,6aS)-4-[(E,3S)-5-ethoxy-3-hydroxypent-1-enyl]-5-hydroxy-2-methylidene-3,3a,4,5,6,6a-hexahydropentalen-1-one Traditional Name: (3aS,4S,5R,6aS)-4-[(E,3S)-5-ethoxy-3-hydroxy-pent-1-enyl]-5-hydroxy-2-methylene-3,3a,4,5,6,6a-hexahydropentalen-1-one Formula: C16H24O4 MolecularWeight: 280.35936

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(C=CC1C(CC2C1CC(=C)C2=O)O)O

Isomeric SMILES

CCOCC[C@@H](/C=C/[C@@H]1[C@@H](C[C@H]2[C@H]1CC(=C)C2=O)O)O

InChI

InChI=1S/C16H24O4/c1-3-20-7-6-11(17)4-5-12-13-8-10(2)16(19)14(13)9-15(12)18/h4-5,11-15,17-18H,2-3,6-9H2,1H3/b5-4+/t11-,12+,13+,14+,15-/m1/s1