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PEDZYCDSAWVMRN-DZEHZSJLSA-N

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PEDZYCDSAWVMRN-DZEHZSJLSA-N
SpectraBase Compound ID 73zwyHaodSu
InChI InChI=1S/C36H38O12/c1-15-35(47-17(3)37)31-23(13-45-15)33(39)27-21(9-19(41-5)11-25(27)43-7)29(31)30-22-10-20(42-6)12-26(44-8)28(22)34(40)24-14-46-16(2)36(32(24)30)48-18(4)38/h9-12,15-16,35-36,39-40H,13-14H2,1-8H3/t15-,16-,35+,36+/m0/s1
InChIKey PEDZYCDSAWVMRN-DZEHZSJLSA-N
Mol Weight 662.7 g/mol
Molecular Formula C36H38O12
Exact Mass 662.236327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B1pco0Zjsyi
Name PEDZYCDSAWVMRN-DZEHZSJLSA-N
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38O12
InChI InChI=1S/C36H38O12/c1-15-35(47-17(3)37)31-23(13-45-15)33(39)27-21(9-19(41-5)11-25(27)43-7)29(31)30-22-10-20(42-6)12-26(44-8)28(22)34(40)24-14-46-16(2)36(32(24)30)48-18(4)38/h9-12,15-16,35-36,39-40H,13-14H2,1-8H3/t15-,16-,35+,36+/m0/s1
InChIKey PEDZYCDSAWVMRN-DZEHZSJLSA-N
Literature Reference Author M.ISAKA,S.PALASARN,S.SUPTHINA,S.KOMWIJIT,J.J.LUANGSAARD
Literature Reference Citation J.NAT.PROD.,74,782(2011)
Literature Reference DOI 10.1021/np100849x
Molecular Weight 662.691 g/mol
Sample ID 37310
Solvent CDCl3