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PREMYRSINOL-3,7-DIPROPANOATE-5-ISOBUTYRATE-7,13-DIACETATE

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PREMYRSINOL-3,7-DIPROPANOATE-5-ISOBUTYRATE-7,13-DIACETATE
SpectraBase Compound ID FZ8Y7wtAqDt
InChI InChI=1S/C34H50O12/c1-11-22(37)42-15-33-21(43-18(6)35)13-20-24(31(20,8)9)27(33)32(10,46-19(7)36)30(40)34(41)14-17(5)26(44-23(38)12-2)25(34)28(33)45-29(39)16(3)4/h16-17,20-21,24-28,41H,11-15H2,1-10H3/t17-,20-,21+,24-,25+,26-,27-,28+,32-,33+,34+/m0/s1
InChIKey ADUFIUPYZSUZKB-UOGDBKCJSA-N
Mol Weight 650.8 g/mol
Molecular Formula C34H50O12
Exact Mass 650.330227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Xicgvp2sJc
Name PREMYRSINOL-3,7-DIPROPANOATE-5-ISOBUTYRATE-7,13-DIACETATE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H50O12
InChI InChI=1S/C34H50O12/c1-11-22(37)42-15-33-21(43-18(6)35)13-20-24(31(20,8)9)27(33)32(10,46-19(7)36)30(40)34(41)14-17(5)26(44-23(38)12-2)25(34)28(33)45-29(39)16(3)4/h16-17,20-21,24-28,41H,11-15H2,1-10H3/t17-,20-,21+,24-,25+,26-,27-,28+,32-,33+,34+/m0/s1
InChIKey ADUFIUPYZSUZKB-UOGDBKCJSA-N
Literature Reference Author G.APPENDINO,E.BELLORO,G.C.TRON,J.JAKUPOVIC,M.BALLERO
Literature Reference Citation J.NAT.PROD.,62,1399(1999)
Literature Reference DOI 10.1021/np990209u
Molecular Weight 650.764 g/mol
Solvent CDCl3
Source File Reference UWCS20810