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2-[(1S,2R,4aS,4bR,8R,8aR,10aR)-1-acetoxy-8-carbomethoxy-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9,10,10a-decahydro-1H-phenanthren-2-yl]acetic acid

View entire compound with spectra: 1 NMR

2-[(1S,2R,4aS,4bR,8R,8aR,10aR)-1-acetoxy-8-carbomethoxy-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9,10,10a-decahydro-1H-phenanthren-2-yl]acetic acid
SpectraBase Compound ID JJK8gMmiwt2
InChI InChI=1S/C23H36O6/c1-14(24)29-19-15-7-8-17-22(3,10-6-11-23(17,4)20(27)28-5)16(15)9-12-21(19,2)13-18(25)26/h15-17,19H,6-13H2,1-5H3,(H,25,26)/t15-,16+,17-,19+,21-,22-,23-/m1/s1
InChIKey DUZIOMXDDMDMDD-TUNFKKLJSA-N
Mol Weight 408.5 g/mol
Molecular Formula C23H36O6
Exact Mass 408.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CkBpapbLJl8
Name 2-[(1S,2R,4aS,4bR,8R,8aR,10aR)-1-acetoxy-8-carbomethoxy-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9,10,10a-decahydro-1H-phenanthren-2-yl]acetic acid
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36O6
InChI InChI=1S/C23H36O6/c1-14(24)29-19-15-7-8-17-22(3,10-6-11-23(17,4)20(27)28-5)16(15)9-12-21(19,2)13-18(25)26/h15-17,19H,6-13H2,1-5H3,(H,25,26)/t15-,16+,17-,19+,21-,22-,23-/m1/s1
InChIKey DUZIOMXDDMDMDD-TUNFKKLJSA-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 408.535 g/mol
Solvent CDCl3
Source File Reference UWCS16170