1,4-Ethano-1H-cyclopent[c]oxepin-3-methanol, octahydro-1,3,6-trimethyl-, 3-acetate, (1S,3S,4R,5aR,6R,8aR)-

CAS Registry Number®

173693-49-7

CAS Name

1,4-Ethano-1H-cyclopent[c]oxepin-3-methanol, octahydro-1,3,6-trimethyl-, 3-acetate, (1S,3S,4R,5aR,6R,8aR)-

Molecular Formula

C17H28O3

Molecular Mass

280.40

Cite this Page

1,4-Ethano-1H-cyclopent[c]oxepin-3-methanol, octahydro-1,3,6-trimethyl-, 3-acetate, (1S,3S,4R,5aR,6R,8aR)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=173693-49-7 (retrieved 2024-11-08) (CAS RN: 173693-49-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H28O3/c1-11-5-6-15-14(11)9-13-7-8-16(15,3)20-17(13,4)10-19-12(2)18/h11,13-15H,5-10H2,1-4H3

InChIKey

InChIKey=DWBIYQVLFODAMM-UHFFFAOYSA-N

SMILES

CC12C3C(CC(C(COC(C)=O)(C)O1)CC2)C(C)CC3

Canonical SMILES

O=C(OCC1(OC2(C)CCC1CC3C(C)CCC32)C)C

Other Names for this Substance

  • 1,4-Ethano-1H-cyclopent[c]oxepin-3-methanol, octahydro-1,3,6-trimethyl-, 3-acetate, (1S,3S,4R,5aR,6R,8aR)-
  • 1,4-Ethano-1H-cyclopent[c]oxepin-3-methanol, octahydro-1,3,6-trimethyl-, acetate, [1S-(1α,3α,4α,5aβ,6α,8aα)]-
  • 1,4-Ethano-1H-cyclopent[c]oxepin-3-methanol, octahydro-1,3,6-trimethyl-, acetate, (1S,3S,4R,5aR,6R,8aR)-
  • Valeracetate

CAS INSIGHTSTM
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