Vitexilactone

CAS Registry Number®

61263-49-8
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CAS Name

Vitexilactone

Molecular Formula

C22H34O5

Molecular Mass

378.50

Cite this Page

Vitexilactone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61263-49-8 (retrieved 2024-05-01) (CAS RN: 61263-49-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    148-149 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H34O5/c1-14-11-17(27-15(2)23)19-20(3,4)8-6-9-21(19,5)22(14,25)10-7-16-12-18(24)26-13-16/h12,14,17,19,25H,6-11,13H2,1-5H3/t14-,17-,19+,21+,22-/m1/s1

InChIKey

InChIKey=FBWWXAGANVJTLU-HEXLTJKYSA-N

SMILES

C[C@]12[C@@]([C@H](OC(C)=O)C[C@@H](C)[C@@]1(CCC=3COC(=O)C3)O)(C(C)(C)CCC2)[H]

Canonical SMILES

O=C1OCC(=C1)CCC2(O)C(C)CC(OC(=O)C)C3C(C)(C)CCCC32C

Other Names for this Substance

  • 2(5H)-Furanone, 4-[2-[(1R,2R,4R,4aS,8aS)-4-(acetyloxy)decahydro-1-hydroxy-2,5,5,8a-tetramethyl-1-naphthalenyl]ethyl]-
  • 2(5H)-Furanone, 4-[2-[4-(acetyloxy)decahydro-1-hydroxy-2,5,5,8a-tetramethyl-1-naphthalenyl]ethyl]-, [1R-(1α,2α,4β,4aα,8aβ)]-
  • 4-[2-[(1R,2R,4R,4aS,8aS)-4-(Acetyloxy)decahydro-1-hydroxy-2,5,5,8a-tetramethyl-1-naphthalenyl]ethyl]-2(5H)-furanone
  • Vitexilactone

Deleted or Replaced CAS Registry Numbers

1314094-56-8

CAS INSIGHTSTM
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