3aH-Furo[3,2-c]isobenzofuran-8-methanol, 5,5a,6,7,8,9-hexahydro-α,α,3a,5a-tetramethyl-, 8-acetate, (3aR,5aS,8R,9aR)-

CAS Registry Number®

37209-50-0
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CAS Name

3aH-Furo[3,2-c]isobenzofuran-8-methanol, 5,5a,6,7,8,9-hexahydro-α,α,3a,5a-tetramethyl-, 8-acetate, (3aR,5aS,8R,9aR)-

Molecular Formula

C17H26O4

Molecular Mass

294.39

Cite this Page

3aH-Furo[3,2-c]isobenzofuran-8-methanol, 5,5a,6,7,8,9-hexahydro-α,α,3a,5a-tetramethyl-, 8-acetate, (3aR,5aS,8R,9aR)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=37209-50-0 (retrieved 2024-07-04) (CAS RN: 37209-50-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H26O4/c1-12(18)21-14(2,3)13-6-7-15(4)11-20-16(5)8-9-19-17(15,16)10-13/h8-9,13H,6-7,10-11H2,1-5H3/t13-,15+,16-,17-/m1/s1

InChIKey

InChIKey=YARAJYKHRCCDLG-XLNGHYISSA-N

SMILES

C[C@@]12[C@@]3([C@](C)(OC1)C=CO3)C[C@H]([C@@](OC(C)=O)(C)C)CC2

Canonical SMILES

O=C(OC(C)(C)C1CCC2(C)COC3(C=COC32C1)C)C

Other Names for this Substance

  • 3aH-Furo[3,2-c]isobenzofuran-8-methanol, 5,5a,6,7,8,9-hexahydro-α,α,3a,5a-tetramethyl-, 8-acetate, (3aR,5aS,8R,9aR)-
  • 3aH-Furo[3,2-c]isobenzofuran-8-methanol, 5,5a,6,7,8,9-hexahydro-α,α,3a,5a-tetramethyl-, acetate, (3aR,5aS,8R,9aR)-
  • Phytuberin
  • (-)-Phytuberin

Deleted or Replaced CAS Registry Numbers

39311-20-1, 55304-03-5