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20S,24R-EPOXY-3-BETA,25-XI-DIHYDROXY-DAMMARANE;OCOTILOL-II
SpectraBase Compound ID 4pTgtHKRVkz
InChI InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19?,20-,21?,22?,23-,24+,27-,28+,29+,30+/m0/s1
InChIKey RQBNSDSKUAGBOI-CXMHXJNJSA-N
Mol Weight 460.7 g/mol
Molecular Formula C30H52O3
Exact Mass 460.391646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3jxQd86zspK
Name 20S,24R-EPOXY-3-BETA,25-XI-DIHYDROXY-DAMMARANE;OCOTILOL-II
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O3
InChI InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19?,20-,21?,22?,23-,24+,27-,28+,29+,30+/m0/s1
InChIKey RQBNSDSKUAGBOI-CXMHXJNJSA-N
Literature Reference Author S.FUJITA,R.KASAI,K.OHTANI,K.YAMASAKI,M.H.CHIU,R.L.NIE,O.TANA KA
Literature Reference Citation PHYTOCHEM.,38,465(1995)
Literature Reference DOI 10.1016/0031-9422(94)00608-V
Molecular Weight 460.741 g/mol
Solvent CDCl3
Source File Reference UWMS4804