1-[(5α,7α)-4,5-Epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone

CAS Registry Number®

16196-82-0
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CAS Name

1-[(5α,7α)-4,5-Epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone

Molecular Formula

C23H29NO4

Molecular Mass

383.48

Cite this Page

1-[(5α,7α)-4,5-Epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=16196-82-0 (retrieved 2024-05-07) (CAS RN: 16196-82-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    132-134 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H29NO4/c1-13(25)15-12-21-7-8-23(15,27-4)20-22(21)9-10-24(2)17(21)11-14-5-6-16(26-3)19(28-20)18(14)22/h5-6,15,17,20H,7-12H2,1-4H3/t15-,17-,20-,21-,22+,23-/m1/s1

InChIKey

InChIKey=KRWAWNXEYPCCLG-LLGZQOTFSA-N

SMILES

O(C)[C@@]12[C@]3([C@@]45[C@@]([C@@](CC6=C4C(O3)=C(OC)C=C6)(N(C)CC5)[H])(C[C@@H]1C(C)=O)CC2)[H]

Canonical SMILES

O=C(C)C1CC23CCC1(OC)C4OC=5C(OC)=CC=C6C5C43CCN(C)C2C6

Other Names for this Substance

  • Ethanone, 1-[(5α,7α)-4,5-epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]-
  • 6,14-endo-Ethanotetrahydrothebaine, 7α-acetyl-
  • 6,14-Ethenomorphinan, ethanone deriv.
  • 1-[(5α,7α)-4,5-Epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone
  • Hydrothevinone

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Deleted or Replaced CAS Registry Numbers

98062-11-4, 1178091-23-0

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