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JABOROSALACTONE-12;(20R,22R,23S)-5-BETA,6-BETA-EPOXY-4-BETA,12-BETA,17-BETA,22-TETRAHYDROXY-1-OXO-12,23-CYCLOERGOSTA-2,24-DIEN-26,23-OLIDE

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JABOROSALACTONE-12;(20R,22R,23S)-5-BETA,6-BETA-EPOXY-4-BETA,12-BETA,17-BETA,22-TETRAHYDROXY-1-OXO-12,23-CYCLOERGOSTA-2,24-DIEN-26,23-OLIDE
SpectraBase Compound ID BVILP1VcxoL
InChI InChI=1S/C28H36O8/c1-12-13(2)27(36-22(12)32)21(31)14(3)25(33)9-8-16-15-10-20-28(35-20)19(30)7-6-18(29)23(28,4)17(15)11-26(27,34)24(16,25)5/h6-7,14-17,19-21,30-31,33-34H,8-11H2,1-5H3/t14-,15?,16?,17?,19+,20-,21-,23+,24+,25-,26-,27+,28-/m1/s1
InChIKey JVXBFGLGHWILRJ-RYRIPWCDSA-N
Mol Weight 500.6 g/mol
Molecular Formula C28H36O8
Exact Mass 500.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1iw8pQPKaJO
Name JABOROSALACTONE-12;(20R,22R,23S)-5-BETA,6-BETA-EPOXY-4-BETA,12-BETA,17-BETA,22-TETRAHYDROXY-1-OXO-12,23-CYCLOERGOSTA-2,24-DIEN-26,23-OLIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O8
InChI InChI=1S/C28H36O8/c1-12-13(2)27(36-22(12)32)21(31)14(3)25(33)9-8-16-15-10-20-28(35-20)19(30)7-6-18(29)23(28,4)17(15)11-26(27,34)24(16,25)5/h6-7,14-17,19-21,30-31,33-34H,8-11H2,1-5H3/t14-,15?,16?,17?,19+,20-,21-,23+,24+,25-,26-,27+,28-/m1/s1
InChIKey JVXBFGLGHWILRJ-RYRIPWCDSA-N
Literature Reference Author A.M.CIRIGLIANO,A.S.VELEIRO,J.C.OBERTI,G.BURTON
Literature Reference Citation J.NAT.PROD.,65,1049(2002)
Literature Reference DOI 10.1021/np0200109
Molecular Weight 500.589 g/mol
Solvent CDCl3
Source File Reference UWSI6241