Rosmadial

CAS Registry Number®

85514-31-4

CAS Name

Rosmadial

Molecular Formula

C20H24O5

Molecular Mass

344.40

Cite this Page

Rosmadial.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=85514-31-4 (retrieved 2024-11-08) (CAS RN: 85514-31-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H24O5/c1-11(2)13-8-12(9-21)15-17(16(13)23)25-18(24)20(15)7-5-6-19(3,4)14(20)10-22/h8-11,14,23H,5-7H2,1-4H3/t14-,20+/m0/s1

InChIKey

InChIKey=JBWRHBJFAVSAMJ-VBKZILBWSA-N

SMILES

C(=O)[C@@H]1[C@@]2(C=3C(OC2=O)=C(O)C(C(C)C)=CC3C=O)CCCC1(C)C

Canonical SMILES

O=CC=1C=C(C(O)=C2OC(=O)C3(C12)CCCC(C)(C)C3C=O)C(C)C

Other Names for this Substance

  • Spiro[benzofuran-3(2H),1′-cyclohexane]-2′,4-dicarboxaldehyde, 7-hydroxy-3′,3′-dimethyl-6-(1-methylethyl)-2-oxo-, (1′R,2′S)-
  • Spiro[benzofuran-3(2H),1′-cyclohexane]-2′,4-dicarboxaldehyde, 7-hydroxy-3′,3′-dimethyl-6-(1-methylethyl)-2-oxo-, (1′R-cis)-
  • (1′R,2′S)-7-Hydroxy-3′,3′-dimethyl-6-(1-methylethyl)-2-oxospiro[benzofuran-3(2H),1′-cyclohexane]-2′,4-dicarboxaldehyde
  • (-)-Rosmadial
  • Rosmadial

CAS INSIGHTSTM
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