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(3S,4S,5S,6R,7E,9S)-5,6-EPOXY-3,4,9-TRIHYDROXY-7-MEGASTIGMEN
SpectraBase Compound ID 1zifbhLDyFc
InChI InChI=1S/C13H22O4/c1-8(14)5-6-13-11(2,3)7-9(15)10(16)12(13,4)17-13/h5-6,8-10,14-16H,7H2,1-4H3/b6-5+/t8-,9-,10-,12-,13+/m0/s1
InChIKey XXTIWEZMRZGAMY-XCKXJIOOSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ebIxxuZjDG
Name (3S,4S,5S,6R,7E,9S)-5,6-EPOXY-3,4,9-TRIHYDROXY-7-MEGASTIGMEN
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22O4
InChI InChI=1S/C13H22O4/c1-8(14)5-6-13-11(2,3)7-9(15)10(16)12(13,4)17-13/h5-6,8-10,14-16H,7H2,1-4H3/b6-5+/t8-,9-,10-,12-,13+/m0/s1
InChIKey XXTIWEZMRZGAMY-XCKXJIOOSA-N
Literature Reference Author I.K.LEE,K.H.KIM,S.Y.LEE,S.U.CHOI,K.R.LEE
Literature Reference Citation CHEM.PHARM.BULL.,59,773(2011)
Literature Reference DOI 10.1248/cpb.59.773
Molecular Weight 242.315 g/mol
Source File Reference UWIR3212