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ERGOSTA-5,8,22-TRIEN-3-BETA-OL

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ERGOSTA-5,8,22-TRIEN-3-BETA-OL
SpectraBase Compound ID 5SQdt5gGDdj
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22,24-25,29H,10-17H2,1-6H3/b8-7+/t19-,20-,22+,24-,25+,27+,28-/m1/s1
InChIKey VILFZDAFELACSG-MYFWBUMOSA-N
Mol Weight 396.7 g/mol
Molecular Formula C28H44O
Exact Mass 396.339216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1CuyPr2XAZd
Name ERGOSTA-5,8,22-TRIEN-3-BETA-OL
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22,24-25,29H,10-17H2,1-6H3/b8-7+/t19-,20-,22+,24-,25+,27+,28-/m1/s1
InChIKey VILFZDAFELACSG-MYFWBUMOSA-N
Literature Reference Author A.F.BARRERO,J.E.OLTRA,J.A.POYATOS,D.JIMENEZ,E.OLIVER
Literature Reference Citation J.NAT.PROD.,61,1491(1998)
Literature Reference DOI 10.1021/np980199h
Molecular Weight 396.657 g/mol
Solvent CDCl3
Source File Reference UWGE1160