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3-ACETYLOXY-9-HYDROXY-14-(ERYTHRO-2-METHYL-3-HYDROXYBUTANOYLOXY)-14,15-EPOXYTRIX-5(15)-EN-4,12-OLIDE
SpectraBase Compound ID 11teHunr1XP
InChI InChI=1S/C22H28O9/c1-8(9(2)23)18(26)31-19-11-5-14(25)17-21(4)12-6-22(11,17)13(7-28-19)16(30-20(21)27)15(12)29-10(3)24/h7-9,11-12,14-17,19,23,25H,5-6H2,1-4H3/t8?,9?,11?,12-,14-,15+,16-,17+,19+,21-,22+/m0/s1
InChIKey AHSPVZOCNXATQL-FALNIEMKSA-N
Mol Weight 436.46 g/mol
Molecular Formula C22H28O9
Exact Mass 436.173332 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ApRDSBo7WKU
Name 3-ACETYLOXY-9-HYDROXY-14-(ERYTHRO-2-METHYL-3-HYDROXYBUTANOYLOXY)-14,15-EPOXYTRIX-5(15)-EN-4,12-OLIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O9
InChI InChI=1S/C22H28O9/c1-8(9(2)23)18(26)31-19-11-5-14(25)17-21(4)12-6-22(11,17)13(7-28-19)16(30-20(21)27)15(12)29-10(3)24/h7-9,11-12,14-17,19,23,25H,5-6H2,1-4H3/t8?,9?,11?,12-,14-,15+,16-,17+,19+,21-,22+/m0/s1
InChIKey AHSPVZOCNXATQL-FALNIEMKSA-N
Literature Reference Author C.KOTOWICZ,L.R.HERNANDEZ,C.M.CERDA-GARCIA-ROJAS,M.B.VILLECO, C.A.N.CATALAN,P.JOSE
Literature Reference Citation J.NAT.PROD.,64,1326(2001)
Literature Reference DOI 10.1021/np010191z
Molecular Weight 436.459 g/mol
Solvent CDCl3
Source File Reference UWSI2152