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
C17H28O3Molecular Mass
280.40Cite 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 ) (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