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(20R)-PREGN-5-ENE-3-BETA,11-BETA,20-TRIOL-3,20-DIACETATE
SpectraBase Compound ID DfuFx6WmVgZ
InChI InChI=1S/C25H38O5/c1-14(29-15(2)26)20-8-9-21-19-7-6-17-12-18(30-16(3)27)10-11-24(17,4)23(19)22(28)13-25(20,21)5/h6,14,18-23,28H,7-13H2,1-5H3/t14?,18-,19-,20+,21-,22-,23+,24-,25+/m0/s1
InChIKey LRGGDAUKVPSGHL-YZVCCXIASA-N
Mol Weight 418.6 g/mol
Molecular Formula C25H38O5
Exact Mass 418.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hz5cBWfHzeI
Name (20R)-PREGN-5-ENE-3-BETA,11-BETA,20-TRIOL-3,20-DIACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O5
InChI InChI=1S/C25H38O5/c1-14(29-15(2)26)20-8-9-21-19-7-6-17-12-18(30-16(3)27)10-11-24(17,4)23(19)22(28)13-25(20,21)5/h6,14,18-23,28H,7-13H2,1-5H3/t14?,18-,19-,20+,21-,22-,23+,24-,25+/m0/s1
InChIKey LRGGDAUKVPSGHL-YZVCCXIASA-N
Literature Reference Author J.W.APSIMON,S.BADRIPERSAUD,J.A.BUCCINI,J.EENKHOORN,M.W.GILGA N
Literature Reference Citation CAN.J.CHEM.,58,2703(1980)
Literature Reference DOI 10.1139/v80-430
Molecular Weight 418.574 g/mol
Solvent CDCl3
Source File Reference UWED2796