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3-BETA,5-ALPHA,9-ALPHA-TRIHYDROXY-(22E,24R)-ERGOSTA-7,22-DIEN-6-ONE
SpectraBase Compound ID 6iwoiH5wY5h
InChI InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28(32)16-20(29)11-12-26(28,6)27(23,31)14-13-25(21,22)5/h7-8,15,17-22,29,31-32H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,25+,26+,27+,28-/m0/s1
InChIKey GUERPVMWCQXYEU-IHEPTZRRSA-N
Mol Weight 444.7 g/mol
Molecular Formula C28H44O4
Exact Mass 444.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ELF37St9a1n
Name 3-BETA,5-ALPHA,9-ALPHA-TRIHYDROXY-(22E,24R)-ERGOSTA-7,22-DIEN-6-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O4
InChI InChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)21-9-10-22-23-15-24(30)28(32)16-20(29)11-12-26(28,6)27(23,31)14-13-25(21,22)5/h7-8,15,17-22,29,31-32H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,21+,22-,25+,26+,27+,28-/m0/s1
InChIKey GUERPVMWCQXYEU-IHEPTZRRSA-N
Literature Reference Author Q.Y.MA,L.L.HU,L.M.KONG,S.H.HUANG,H.F.DAI,Y.LI,Y.X.ZHAO
Literature Reference Citation AFR.J.MICBIOL.RES.,7,1543(2013)
Literature Reference DOI 10.5897/ajmr12.1649
Molecular Weight 444.655 g/mol
Solvent CDCl3
Source File Reference UWLU76879