β-Naltrexol

CAS Registry Number®

49625-89-0
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CAS Name

β-Naltrexol

Molecular Formula

C20H25NO4

Molecular Mass

343.42

Cite this Page

β-Naltrexol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=49625-89-0 (retrieved 2024-04-19) (CAS RN: 49625-89-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    175-177 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H25NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,14-15,18,22-24H,1-2,5-10H2/t14-,15-,18+,19+,20-/m1/s1

InChIKey

InChIKey=JLVNEHKORQFVQJ-PYIJOLGTSA-N

SMILES

O[C@]12[C@@]34C=5C(O[C@]3([C@H](O)CC1)[H])=C(O)C=CC5C[C@]2(N(CC6CC6)CC4)[H]

Canonical SMILES

OC1=CC=C2C3=C1OC4C(O)CCC5(O)C(N(CCC345)CC6CC6)C2

Other Names for this Substance

  • Morphinan-3,6,14-triol, 17-(cyclopropylmethyl)-4,5-epoxy-, (5α,6β)-
  • (5α,6β)-17-(Cyclopropylmethyl)-4,5-epoxymorphinan-3,6,14-triol
  • 17-(Cyclopropylmethyl)-4,5α-epoxy-3,14-dihydroxymorphinan-6β-ol
  • 6β-Hydroxynaltrexone
  • β-Naltrexol

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