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OBLONGININE;(22S,25R)-22,26-EPIMINOCHOLEST-5-EN-3-BETA-OL

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OBLONGININE;(22S,25R)-22,26-EPIMINOCHOLEST-5-EN-3-BETA-OL
SpectraBase Compound ID 8J1O0t1u9i1
InChI InChI=1S/C27H45NO/c1-17-5-10-25(28-16-17)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h6,17-18,20-25,28-29H,5,7-16H2,1-4H3/t17-,18+,20+,21+,22-,23+,24?,25+,26+,27-/m1/s1
InChIKey SWTXHUUBYZNDAJ-PWLSSQPVSA-N
Mol Weight 399.7 g/mol
Molecular Formula C27H45NO
Exact Mass 399.350115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AACTMCi85Jc
Name OBLONGININE;(22S,25R)-22,26-EPIMINOCHOLEST-5-EN-3-BETA-OL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45NO
InChI InChI=1S/C27H45NO/c1-17-5-10-25(28-16-17)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h6,17-18,20-25,28-29H,5,7-16H2,1-4H3/t17-,18+,20+,21+,22-,23+,24?,25+,26+,27-/m1/s1
InChIKey SWTXHUUBYZNDAJ-PWLSSQPVSA-N
Literature Reference Author P.R.LOWE,I.H.SADLER,Z.WANG,Y.WANG,M.F.G.STEVENS,L.ZHAO,S.CHE N.G.XU
Literature Reference Citation PHYTOCHEM.,47,887(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00544-X
Molecular Weight 399.660 g/mol
Solvent CDCl3
Source File Reference UWMS407