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5-ALPHA-ERGOSTA-7,22-DIENE-3-BETA,5,6-BETA-TRIOL

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5-ALPHA-ERGOSTA-7,22-DIENE-3-BETA,5,6-BETA-TRIOL
SpectraBase Compound ID Cq27VNZC2a0
InChI InChI=1S/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18?,19-,20+,22-,23+,24+,25-,26-,27-,28+/m1/s1
InChIKey ARXHRTZAVQOQEU-PHZYAEJDSA-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 JC67j6HXhQh
Name 5-ALPHA-ERGOSTA-7,22-DIENE-3-BETA,5,6-BETA-TRIOL
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)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18?,19-,20+,22-,23+,24+,25-,26-,27-,28+/m1/s1
InChIKey ARXHRTZAVQOQEU-PHZYAEJDSA-N
Literature Reference Author M.IORIZZI,L.MINALE,R.RICCIO,J.S.LEE,T.YASUMOTO
Literature Reference Citation J.NAT.PROD.,51,1098(1988)
Literature Reference DOI 10.1021/np50060a008
Molecular Weight 430.671 g/mol
Solvent CD3OD
Source File Reference UWED18093