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SMHYQXJSUROYPE-RAWNPWKASA-N
SpectraBase Compound ID 3dMOnibQsbe
InChI InChI=1S/C37H42N2O15/c1-8-21-23(13-27-30-24(14-28(38-27)35(45)47-7)22-11-9-10-12-26(22)39-30)25(34(44)46-6)15-49-36(21)54-37-33(52-20(5)43)32(51-19(4)42)31(50-18(3)41)29(53-37)16-48-17(2)40/h8-12,15,21,23,28-29,31-33,36-37,39H,1,13-14,16H2,2-7H3/t21-,23+,28+,29-,31-,32+,33-,36+,37+/m0/s1
InChIKey SMHYQXJSUROYPE-RAWNPWKASA-N
Mol Weight 754.7 g/mol
Molecular Formula C37H42N2O15
Exact Mass 754.258519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dqomyw8g1Qt
Name SMHYQXJSUROYPE-RAWNPWKASA-N
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H42N2O15
InChI InChI=1S/C37H42N2O15/c1-8-21-23(13-27-30-24(14-28(38-27)35(45)47-7)22-11-9-10-12-26(22)39-30)25(34(44)46-6)15-49-36(21)54-37-33(52-20(5)43)32(51-19(4)42)31(50-18(3)41)29(53-37)16-48-17(2)40/h8-12,15,21,23,28-29,31-33,36-37,39H,1,13-14,16H2,2-7H3/t21-,23+,28+,29-,31-,32+,33-,36+,37+/m0/s1
InChIKey SMHYQXJSUROYPE-RAWNPWKASA-N
Literature Reference Author M.KITAJIMA,M.YOKOYA,H.TAKAYAMA,N.AIMI
Literature Reference Citation CHEM.PHARM.BULL.,50,1376(2002)
Literature Reference DOI 10.1248/cpb.50.1376
Molecular Weight 754.745 g/mol
Solvent CDCl3
Source File Reference UWMS20089