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DEACETYLTERNATIN;DA-T
SpectraBase Compound ID 8upz6Z7BMeg
InChI InChI=1S/C33H40O22.C2HF3O2/c34-6-17-21(40)24(43)27(46)31(53-17)50-14-1-9(2-15(20(14)39)51-32-28(47)25(44)22(41)18(7-35)54-32)30-16(5-11-12(38)3-10(37)4-13(11)49-30)52-33-29(48)26(45)23(42)19(8-36)55-33;3-2(4,5)1(6)7/h1-5,17-19,21-29,31-36,40-48H,6-8H2,(H2-,37,38,39);(H,6,7)/t17-,18-,19+,21-,22-,23+,24+,25+,26-,27-,28-,29+,31-,32-,33+;/m0./s1
InChIKey QTZMUESREUPALY-BHZSLWSDSA-N
Mol Weight 902.7 g/mol
Molecular Formula C35H41F3O24
Exact Mass 902.193987 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFA4xJqGaXY
Name DEACETYLTERNATIN;DA-T
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H41F3O24
InChI InChI=1S/C33H40O22.C2HF3O2/c34-6-17-21(40)24(43)27(46)31(53-17)50-14-1-9(2-15(20(14)39)51-32-28(47)25(44)22(41)18(7-35)54-32)30-16(5-11-12(38)3-10(37)4-13(11)49-30)52-33-29(48)26(45)23(42)19(8-36)55-33;3-2(4,5)1(6)7/h1-5,17-19,21-29,31-36,40-48H,6-8H2,(H2-,37,38,39);(H,6,7)/t17-,18-,19+,21-,22-,23+,24+,25+,26-,27-,28-,29+,31-,32-,33+;/m0./s1
InChIKey QTZMUESREUPALY-BHZSLWSDSA-N
Literature Reference Author N.TERAHARA,M.ODA,T.MATSUI,Y.OSAJIMA,N.SAITO,K.TOKI,T.HONDA
Literature Reference Citation J.NAT.PROD.,59,139(1996)
Literature Reference DOI 10.1021/np960050a
Molecular Weight 902.691 g/mol
Solvent DMSO-D6:CF3COOD
Source File Reference UWVP2583