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(25R)-3-BETA,7-BETA,12-BETA-TRIHYDROXY-5-ALPHA-SPIROSTANE
SpectraBase Compound ID 1cHZIoKAooT
InChI InChI=1S/C27H44O5/c1-14-5-8-27(31-13-14)15(2)24-21(32-27)11-19-23-18(12-22(30)26(19,24)4)25(3)7-6-17(28)9-16(25)10-20(23)29/h14-24,28-30H,5-13H2,1-4H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+,24-,25-,26+,27+/m0/s1
InChIKey RITLMVFAPHKTTN-SZPFVBOASA-N
Mol Weight 448.6 g/mol
Molecular Formula C27H44O5
Exact Mass 448.318875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E9oQgORgmDX
Name (25R)-3-BETA,7-BETA,12-BETA-TRIHYDROXY-5-ALPHA-SPIROSTANE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O5
InChI InChI=1S/C27H44O5/c1-14-5-8-27(31-13-14)15(2)24-21(32-27)11-19-23-18(12-22(30)26(19,24)4)25(3)7-6-17(28)9-16(25)10-20(23)29/h14-24,28-30H,5-13H2,1-4H3/t14-,15-,16+,17-,18-,19-,20-,21-,22+,23+,24-,25-,26+,27+/m0/s1
InChIKey RITLMVFAPHKTTN-SZPFVBOASA-N
Literature Reference Author P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK
Literature Reference Citation MAGN.RES.CHEM.,33,923(1995)
Literature Reference DOI 10.1002/mrc.1260331202
Molecular Weight 448.643 g/mol
Solvent CDCl3
Source File Reference UWCS22118