Amcinafide

CAS Registry Number®

7332-27-6
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CAS Name

Amcinafide

Molecular Formula

C29H33FO6

Molecular Mass

496.57

Cite this Page

Amcinafide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=7332-27-6 (retrieved 2024-04-25) (CAS RN: 7332-27-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H33FO6/c1-25-12-11-19(32)13-18(25)9-10-20-21-14-24-29(23(34)16-31,26(21,2)15-22(33)28(20,25)30)36-27(3,35-24)17-7-5-4-6-8-17/h4-8,11-13,20-22,24,31,33H,9-10,14-16H2,1-3H3/t20-,21-,22-,24+,25-,26-,27+,28-,29+/m0/s1

InChIKey

InChIKey=HCKFPALGXKOOBK-NRYMJLQJSA-N

SMILES

C(CO)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(O[C@](C)(O2)C4=CC=CC=C4)[H])([C@]5([C@](F)([C@@H](O)C3)[C@]6(C)C(CC5)=CC(=O)C=C6)[H])[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C4CC5OC(OC5(C(=O)CO)C4(C)CC(O)C32F)(C=6C=CC=CC6)C)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,21-dihydroxy-16,17-[[(1R)-1-phenylethylidene]bis(oxy)]-, (11β,16α)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,16α,17,21-tetrahydroxy-, cyclic 16,17-acetal with acetophenone, (R)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,21-dihydroxy-16,17-[(1-phenylethylidene)bis(oxy)]-, [11β,16α(R)]-
  • 2H-Naphth[2′,1′:4,5]indeno[1,2-d][1,3]dioxole, pregn-4-ene-3,20-dione deriv.
  • (11β,16α)-9-Fluoro-11,21-dihydroxy-16,17-[[(1R)-1-phenylethylidene]bis(oxy)]pregna-1,4-diene-3,20-dione

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