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(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(3-chloro-2-keto-propyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester

View entire compound with spectra: 1 NMR

(1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(3-chloro-2-keto-propyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
SpectraBase Compound ID He7yozXC7xa
InChI InChI=1S/C24H37ClO5/c1-15(26)30-20-17-7-8-19-23(3,10-6-11-24(19,4)21(28)29-5)18(17)9-12-22(20,2)13-16(27)14-25/h17-20H,6-14H2,1-5H3/t17-,18+,19-,20+,22-,23-,24-/m1/s1
InChIKey WYTMSGWEDVOSOX-UEMXEBGWSA-N
Mol Weight 441.0 g/mol
Molecular Formula C24H37ClO5
Exact Mass 440.232952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SqTedrZTQy
Name (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(3-chloro-2-keto-propyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H37ClO5
InChI InChI=1S/C24H37ClO5/c1-15(26)30-20-17-7-8-19-23(3,10-6-11-24(19,4)21(28)29-5)18(17)9-12-22(20,2)13-16(27)14-25/h17-20H,6-14H2,1-5H3/t17-,18+,19-,20+,22-,23-,24-/m1/s1
InChIKey WYTMSGWEDVOSOX-UEMXEBGWSA-N
Literature Reference Author A.SANFELICIANO,M.MEDARDE,F.TOME,B.HEBRERO,E.CABALLERO
Literature Reference Citation MAGN.RES.CHEM.,27,1166(1989)
Literature Reference DOI 10.1002/mrc.1260271211
Molecular Weight 441.008 g/mol
Solvent CDCl3
Source File Reference UWCS16171