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3-BETA,7-ALPHA-DIHYDROXY-24,28-EPOXYERGOST-5-ENE;ISOMER-#1

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3-BETA,7-ALPHA-DIHYDROXY-24,28-EPOXYERGOST-5-ENE;ISOMER-#1
SpectraBase Compound ID 3leUkhC74z8
InChI InChI=1S/C28H46O3/c1-17(2)28(16-31-28)13-8-18(3)21-6-7-22-25-23(10-12-27(21,22)5)26(4)11-9-20(29)14-19(26)15-24(25)30/h15,17-18,20-25,29-30H,6-14,16H2,1-5H3/t18-,20+,21-,22+,23+,24-,25+,26+,27-,28?/m1/s1
InChIKey NEKARFIZRJHOEJ-ZNCVFNLDSA-N
Mol Weight 430.7 g/mol
Molecular Formula C28H46O3
Exact Mass 430.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 83jxYovZo9R
Name 24,28-EPOXY-ERGOST-5-ENE-3-BETA,7-ALPHA-DIOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H46O3
InChI InChI=1S/C28H46O3/c1-17(2)28(16-31-28)13-8-18(3)21-6-7-22-25-23(10-12-27(21,22)5)26(4)11-9-20(29)14-19(26)15-24(25)30/h15,17-18,20-25,29-30H,6-14,16H2,1-5H3/t18-,20+,21-,22+,23+,24-,25+,26+,27-,28?/m1/s1
InChIKey NEKARFIZRJHOEJ-ZNCVFNLDSA-N
Literature Reference Author A.A.L.GUNATILAKA,G.SAMARANAYAKE,D.G.I.KINGSTON,G.HOFFMANN,R. K.JOHNSON
Literature Reference Citation J.NAT.PROD.,55,1648(1992)
Literature Reference DOI 10.1021/np50089a014
Molecular Weight 430.671 g/mol
Solvent CDCl3
Source File Reference UWCS4201