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3-BETA,5-ALPHA,6-BETA,7-ALPHA-TETRAHYDROXY-CHOLEST-8(9)-EN-11-ONE
SpectraBase Compound ID 16SykFf5jIi
InChI InChI=1S/C27H44O5/c1-15(2)7-6-8-16(3)18-9-10-19-21-22(20(29)14-25(18,19)4)26(5)12-11-17(28)13-27(26,32)24(31)23(21)30/h15-19,23-24,28,30-32H,6-14H2,1-5H3/t16-,17+,18-,19+,23+,24-,25-,26-,27+/m1/s1
InChIKey SFIBNALHKRCVQL-SUQVONJISA-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 CMFuQf57bMX
Name 3-BETA,5-ALPHA,6-BETA,7-ALPHA-TETRAHYDROXY-CHOLEST-8(9)-EN-11-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O5
InChI InChI=1S/C27H44O5/c1-15(2)7-6-8-16(3)18-9-10-19-21-22(20(29)14-25(18,19)4)26(5)12-11-17(28)13-27(26,32)24(31)23(21)30/h15-19,23-24,28,30-32H,6-14H2,1-5H3/t16-,17+,18-,19+,23+,24-,25-,26-,27+/m1/s1
InChIKey SFIBNALHKRCVQL-SUQVONJISA-N
Literature Reference Author A.AIELLO,E.FATTORUSSO,M.MENNA,R.CARNUCCIO,T.IUVONE
Literature Reference Citation STEROIDS,60,666(1995)
Literature Reference DOI 10.1016/0039-128x(95)00055-u
Molecular Weight 448.643 g/mol
Source File Reference UWLU73854