Propanoic acid, 2-methyl-, (3S,3aR,4S,6S,6aS,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl ester

CAS Registry Number®

68799-88-2
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CAS Name

Propanoic acid, 2-methyl-, (3S,3aR,4S,6S,6aS,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl ester

Molecular Formula

C23H32O8

Molecular Mass

436.50

Cite this Page

Propanoic acid, 2-methyl-, (3S,3aR,4S,6S,6aS,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68799-88-2 (retrieved 2024-09-19) (CAS RN: 68799-88-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H32O8/c1-11(2)20(26)28-16-10-22(6,30-13(4)24)15-9-8-12(3)17(15)19-18(16)23(7,21(27)29-19)31-14(5)25/h8,11,15-19H,9-10H2,1-7H3/t15-,16-,17+,18+,19-,22-,23-/m0/s1

InChIKey

InChIKey=YNZANXMCWKBMJS-OEQVYJHJSA-N

SMILES

O(C(C(C)C)=O)[C@@H]1[C@@]2([C@]([C@]3([C@@]([C@](OC(C)=O)(C)C1)(CC=C3C)[H])[H])(OC(=O)[C@]2(OC(C)=O)C)[H])[H]

Canonical SMILES

O=C(OC1(C(=O)OC2C3C(=CCC3C(OC(=O)C)(C)CC(OC(=O)C(C)C)C21)C)C)C

Other Names for this Substance

  • Propanoic acid, 2-methyl-, (3S,3aR,4S,6S,6aS,9aS,9bS)-3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl ester
  • Propanoic acid, 2-methyl-, 3,6-bis(acetyloxy)-2,3,3a,4,5,6,6a,7,9a,9b-decahydro-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl ester, [3S-(3α,3aα,4α,6β,6aβ,9aβ,9bα)]-
  • Azuleno[4,5-b]furan, propanoic acid deriv.
  • Polhovolide