Orobanchyl acetate

CAS Registry Number®

1413843-71-6

CAS Name

Orobanchyl acetate

Molecular Formula

C21H24O7

Molecular Mass

388.41

Cite this Page

Orobanchyl acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1413843-71-6 (retrieved 2024-11-27) (CAS RN: 1413843-71-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H24O7/c1-10-8-14(27-19(10)23)25-9-13-15-17(26-11(2)22)12-6-5-7-21(3,4)16(12)18(15)28-20(13)24/h8-9,14-15,17-18H,5-7H2,1-4H3/b13-9+/t14-,15-,17+,18-/m1/s1

InChIKey

InChIKey=DLRIUVHQJRZTMZ-PLPBJLQDSA-N

SMILES

O(C(C)=O)[C@@H]1[C@@]/2([C@](C3=C1CCCC3(C)C)(OC(=O)\C2=C\O[C@H]4C=C(C)C(=O)O4)[H])[H]

Canonical SMILES

O=C1OC(OC=C2C(=O)OC3C4=C(CCCC4(C)C)C(OC(=O)C)C23)C=C1C

Other Names for this Substance

  • 2H-Indeno[1,2-b]furan-2-one, 4-(acetyloxy)-3-[[[(2R)-2,5-dihydro-4-methyl-5-oxo-2-furanyl]oxy]methylene]-3,3a,4,5,6,7,8,8b-octahydro-8,8-dimethyl-, (3E,3aR,4R,8bR)-
  • (3E,3aR,4R,8bR)-4-(Acetyloxy)-3-[[[(2R)-2,5-dihydro-4-methyl-5-oxo-2-furanyl]oxy]methylene]-3,3a,4,5,6,7,8,8b-octahydro-8,8-dimethyl-2H-indeno[1,2-b]furan-2-one
  • Alectrol
  • (+)-Orobanchyl acetate
  • Orobanchyl acetate

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Deleted or Replaced CAS Registry Numbers

143572-84-3

CAS INSIGHTSTM
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