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object
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_id
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BbGHkcoZs8R
spectrumID
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BbGHkcoZs8R
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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DEOXYTIGOGENIN=(25R)-5-ALPHA-SPIROSTAN
SpectraBase Compound ID 93YjNojIERD
InChI InChI=1S/C27H44O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h17-24H,5-16H2,1-4H3/t17-,18-,19+,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1
InChIKey INLFWQCRAJUDCR-UQNFBJEVSA-N
Mol Weight 400.6 g/mol
Molecular Formula C27H44O2
Exact Mass 400.334131 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BbGHkcoZs8R
Name DEOXYTIGOGENIN=(25R)-5-ALPHA-SPIROSTAN
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O2
InChI InChI=1S/C27H44O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h17-24H,5-16H2,1-4H3/t17-,18-,19+,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1
InChIKey INLFWQCRAJUDCR-UQNFBJEVSA-N
Literature Reference Author H.EGGERT,C.DJERASSI
Literature Reference Citation TETRAH.LETT.,16,3635(1975)
Literature Reference DOI 10.1016/S0040-4039(00)91344-3
Molecular Weight 400.645 g/mol
Solvent CDCl3
Source File Reference UNIW17006
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