Miroestrol

CAS Registry Number®

2618-41-9

CAS Name

Miroestrol

Molecular Formula

C20H22O6

Molecular Mass

358.39

Cite this Page

Miroestrol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2618-41-9 (retrieved 2024-11-21) (CAS RN: 2618-41-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    270 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H22O6/c1-18(2)11-6-19(24)7-14(22)20(25,16(11)17(19)23)12-8-26-13-5-9(21)3-4-10(13)15(12)18/h3-5,8,11,15-17,21,23-25H,6-7H2,1-2H3/t11-,15+,16-,17+,19+,20-/m0/s1

InChIKey

InChIKey=RJKLDOLOCIQYFS-PRTISISMSA-N

SMILES

O[C@@]12[C@]3([C@@](C(C)(C)[C@]4(C1=COC=5C4=CC=C(O)C5)[H])(C[C@](O)([C@@H]3O)CC2=O)[H])[H]

Canonical SMILES

O=C1CC2(O)CC3C(C2O)C1(O)C4=COC5=CC(O)=CC=C5C4C3(C)C

Other Names for this Substance

  • 2,12-Methano-1H-benzo[b]naphtho[2,1-d]pyran-4(4aH)-one, 2,3,10b,11,12,12a-hexahydro-1,2,4a,8-tetrahydroxy-11,11-dimethyl-, (1R,2R,4aS,10bR,12S,12aS)-
  • 2,12-Methano-1H-benzo[b]naphtho[2,1-d]pyran-4(4aαH)-one, 2,3,10b,11,12,12a-hexahydro-1,2α,4a,8-tetrahydroxy-11,11-dimethyl-
  • 2,12-Methano-1H-benzo[b]naphtho[2,1-d]pyran-4(4aH)-one, 2,3,10b,11,12,12a-hexahydro-1,2,4a,8-tetrahydroxy-11,11-dimethyl-, [1R-(1α,2β,4aβ,10bβ,12α,12aβ)]-
  • Mirestrol
  • 2,12-Methano-1H-benzo[b]naphtho[2,1-d]pyran-4(4aH)-one, 2,3,10b,11,12,12a-hexahydro-1,2,4a,8-tetrahydroxy-11,11-dimethyl-

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration