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WITHALONGOLIDE_B_4,19-DIACETATE

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WITHALONGOLIDE_B_4,19-DIACETATE
SpectraBase Compound ID GujlD6vRgm0
InChI InChI=1S/C32H42O8/c1-16-13-25(39-29(36)17(16)2)18(3)22-7-8-23-21-14-28-32(40-28)27(38-20(5)34)10-9-26(35)31(32,15-37-19(4)33)24(21)11-12-30(22,23)6/h9-10,18,21-25,27-28H,7-8,11-15H2,1-6H3/t18-,21-,22+,23-,24-,25+,27-,28+,30+,31-,32+/m0/s1
InChIKey QBVJUNNNZGDOHF-NSFDSCTRSA-N
Mol Weight 554.7 g/mol
Molecular Formula C32H42O8
Exact Mass 554.287968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9JCw7yRbIYo
Name WITHALONGOLIDE_B_4,19-DIACETATE
Compound Number 2B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H42O8
InChI InChI=1S/C32H42O8/c1-16-13-25(39-29(36)17(16)2)18(3)22-7-8-23-21-14-28-32(40-28)27(38-20(5)34)10-9-26(35)31(32,15-37-19(4)33)24(21)11-12-30(22,23)6/h9-10,18,21-25,27-28H,7-8,11-15H2,1-6H3/t18-,21-,22+,23-,24-,25+,27-,28+,30+,31-,32+/m0/s1
InChIKey QBVJUNNNZGDOHF-NSFDSCTRSA-N
Literature Reference Author H.ZHANG,A.K.SAMADI,R.J.GALLAGHER,J.J.ARAYA,X.TONG,V.W.DAY,M. S.COHEN,K.KINDSCHER,
Literature Reference Citation J.NAT.PROD.,74,2532(2011)
Literature Reference DOI 10.1021/np200635r
Molecular Weight 554.681 g/mol
Sample ID 39628
Solvent CDCl3