Ilimaquinone

CAS Registry Number®

71678-03-0

CAS Name

Ilimaquinone

Molecular Formula

C22H30O4

Molecular Mass

358.47

Cite this Page

Ilimaquinone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71678-03-0 (retrieved 2024-11-25) (CAS RN: 71678-03-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    108-110 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H30O4/c1-13-7-6-8-18-21(13,3)10-9-14(2)22(18,4)12-15-19(24)16(23)11-17(26-5)20(15)25/h11,14,18,24H,1,6-10,12H2,2-5H3/t14-,18+,21+,22+/m0/s1

InChIKey

InChIKey=JJWITJNSXCXULM-YVUMSICPSA-N

SMILES

C([C@@]1(C)[C@]2([C@](C)(CC[C@@H]1C)C(=C)CCC2)[H])C=3C(=O)C(OC)=CC(=O)C3O

Canonical SMILES

O=C1C=C(OC)C(=O)C(=C1O)CC2(C)C(C)CCC3(C(=C)CCCC32)C

Other Names for this Substance

  • 2,5-Cyclohexadiene-1,4-dione, 3-[[(1R,2S,4aS,8aS)-decahydro-1,2,4a-trimethyl-5-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-methoxy-
  • 2,5-Cyclohexadiene-1,4-dione, 3-[(decahydro-1,2,4a-trimethyl-5-methylene-1-naphthalenyl)methyl]-2-hydroxy-5-methoxy-, [1R-(1α,2β,4aβ,8aα)]-
  • 3-[[(1R,2S,4aS,8aS)-Decahydro-1,2,4a-trimethyl-5-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-methoxy-2,5-cyclohexadiene-1,4-dione
  • Ilimaquinone
  • Illimaquinone

View All

Deleted or Replaced CAS Registry Numbers

820243-60-5

CAS INSIGHTSTM
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