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3-ALPHA-CYANO-3-O-(ALPHA-D-GLUCOPYRANOSYL)-ANDROST-4-ENE-17-BETA-OL;COMNPOUND-#18
SpectraBase Compound ID 41h5HfBvY1J
InChI InChI=1S/C26H39NO7/c1-24-9-10-26(13-27,34-23-22(32)21(31)20(30)18(12-28)33-23)11-14(24)3-4-15-16-5-6-19(29)25(16,2)8-7-17(15)24/h11,15-23,28-32H,3-10,12H2,1-2H3/t15-,16-,17-,18+,19-,20+,21-,22+,23+,24-,25-,26-/m0/s1
InChIKey UNJMZKCLZLFZDA-RTNCBEQCSA-N
Mol Weight 477.6 g/mol
Molecular Formula C26H39NO7
Exact Mass 477.272653 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1Eij3zTqvO
Name 3-ALPHA-CYANO-3-O-(ALPHA-D-GLUCOPYRANOSYL)-ANDROST-4-ENE-17-BETA-OL;COMNPOUND-#18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H39NO7
InChI InChI=1S/C26H39NO7/c1-24-9-10-26(13-27,34-23-22(32)21(31)20(30)18(12-28)33-23)11-14(24)3-4-15-16-5-6-19(29)25(16,2)8-7-17(15)24/h11,15-23,28-32H,3-10,12H2,1-2H3/t15-,16-,17-,18+,19-,20+,21-,22+,23+,24-,25-,26-/m0/s1
InChIKey UNJMZKCLZLFZDA-RTNCBEQCSA-N
Literature Reference Author A.TOBARI,T.SHIMIZU,H.MIYAMAE,A.NAGASAWA,M.KAWASE,S.SAITO
Literature Reference Citation CARBOHYDR.RES.,310,239(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00192-X
Molecular Weight 477.598 g/mol
Solvent CDCl3
Source File Reference UWGE2933