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(3R*,4S*,8R*,9S*,13R*,14R*)-16-HYDROXY-9-ACETOXY-8-EPI-ISOSPHAERODIENE-2
SpectraBase Compound ID 4PaapsZ7Zhe
InChI InChI=1S/C22H34O3/c1-13(2)18-6-7-19-17-10-16(12-23)11-20(25-15(4)24)21(17)14(3)8-9-22(18,19)5/h10,13,17-21,23H,3,6-9,11-12H2,1-2,4-5H3/t17-,18-,19-,20+,21+,22+/m1/s1
InChIKey ZDZOSEOBJNWVFT-UQOPEDAQSA-N
Mol Weight 346.5 g/mol
Molecular Formula C22H34O3
Exact Mass 346.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iu3AZ5lNQBN
Name (3R*,4S*,8R*,9S*,13R*,14R*)-16-HYDROXY-9-ACETOXY-8-EPI-ISOSPHAERODIENE-2
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O3
InChI InChI=1S/C22H34O3/c1-13(2)18-6-7-19-17-10-16(12-23)11-20(25-15(4)24)21(17)14(3)8-9-22(18,19)5/h10,13,17-21,23H,3,6-9,11-12H2,1-2,4-5H3/t17-,18-,19-,20+,21+,22+/m1/s1
InChIKey ZDZOSEOBJNWVFT-UQOPEDAQSA-N
Literature Reference Author V.SMYRNIOTOPOULOS,C.VAGIAS,V.ROUSSIS
Literature Reference Citation MAR.DRUGS,7,184(2009)
Literature Reference DOI 10.3390/md7020184
Molecular Weight 346.510 g/mol
Source File Reference UWIR6304