(3S,3aR,4S,6S,9bS)-4-(Acetyloxy)-3a,5,6,9b-tetrahydro-6-hydroxy-3,6,9-trimethyl-4H-cyclohepta[2,1-b:3,4-c′]difuran-2(3H)-one

CAS Registry Number®

142449-62-5

CAS Name

(3S,3aR,4S,6S,9bS)-4-(Acetyloxy)-3a,5,6,9b-tetrahydro-6-hydroxy-3,6,9-trimethyl-4H-cyclohepta[2,1-b:3,4-c′]difuran-2(3H)-one

Molecular Formula

C16H20O6

Molecular Mass

308.33

Cite this Page

(3S,3aR,4S,6S,9bS)-4-(Acetyloxy)-3a,5,6,9b-tetrahydro-6-hydroxy-3,6,9-trimethyl-4H-cyclohepta[2,1-b:3,4-c′]difuran-2(3H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=142449-62-5 (retrieved 2025-02-22) (CAS RN: 142449-62-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H20O6/c1-7-12-11(21-9(3)17)5-16(4,19)10-6-20-8(2)13(10)14(12)22-15(7)18/h6-7,11-12,14,19H,5H2,1-4H3/t7-,11-,12+,14-,16-/m0/s1

InChIKey

InChIKey=KOUVNGDGNNAPQW-LWFZOEDRSA-N

SMILES

O(C(C)=O)[C@@H]1[C@@]2([C@@](C=3C([C@@](C)(O)C1)=COC3C)(OC(=O)[C@H]2C)[H])[H]

Canonical SMILES

O=C(OC1CC(O)(C2=COC(=C2C3OC(=O)C(C)C31)C)C)C

Other Names for this Substance

  • 4H-Cyclohepta[2,1-b:3,4-c′]difuran-2(3H)-one, 4-(acetyloxy)-3a,5,6,9b-tetrahydro-6-hydroxy-3,6,9-trimethyl-, (3S,3aR,4S,6S,9bS)-
  • 4H-Cyclohepta[2,1-b:3,4-c′]difuran-2(3H)-one, 4-(acetyloxy)-3a,5,6,9b-tetrahydro-6-hydroxy-3,6,9-trimethyl-, [3S-(3α,3aα,4α,6β,9bβ)]-
  • (3S,3aR,4S,6S,9bS)-4-(Acetyloxy)-3a,5,6,9b-tetrahydro-6-hydroxy-3,6,9-trimethyl-4H-cyclohepta[2,1-b:3,4-c′]difuran-2(3H)-one
  • 8-Acetylegeloide
  • 3-Oxaachillicin

CAS INSIGHTSTM
Samples on a microarray, illustration