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ERGOSTA-8(14),(22E)-DIENE-3-BETA,5-ALPHA,6-BETA,7-ALPHA-TETRAOL
SpectraBase Compound ID JSxlYPTiKs8
InChI InChI=1S/C28H46O4/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27,32)25(31)24(23)30/h7-8,16-20,22,24-25,29-32H,9-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,22-,24-,25+,26+,27+,28-/m0/s1
InChIKey WHUHGDKCTXRPAK-GPOYPAKQSA-N
Mol Weight 446.7 g/mol
Molecular Formula C28H46O4
Exact Mass 446.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HjeDf5TtKH
Name ERGOSTA-8(14),(22E)-DIENE-3-BETA,5-ALPHA,6-BETA,7-ALPHA-TETRAOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H46O4
InChI InChI=1S/C28H46O4/c1-16(2)17(3)7-8-18(4)20-9-10-21-23-22(12-13-26(20,21)5)27(6)14-11-19(29)15-28(27,32)25(31)24(23)30/h7-8,16-20,22,24-25,29-32H,9-15H2,1-6H3/b8-7+/t17-,18+,19-,20+,22-,24-,25+,26+,27+,28-/m0/s1
InChIKey WHUHGDKCTXRPAK-GPOYPAKQSA-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 446.671 g/mol
Solvent CDCl3
Source File Reference UWLU76881