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UZEDMSSSHUUMFP-YLKNCTOASA-N

View entire compound with spectra: 1 NMR

UZEDMSSSHUUMFP-YLKNCTOASA-N
SpectraBase Compound ID 3QxkIrNzUJ0
InChI InChI=1S/C45H60O12/c1-30(19-13-14-20-31(2)25-17-27-34(5)43(50)51-12)21-15-22-32(3)23-16-24-33(4)26-18-28-45(10,11)57-44-42(55-38(9)49)41(54-37(8)48)40(53-36(7)47)39(56-44)29-52-35(6)46/h13-27,39-42,44H,28-29H2,1-12H3/b14-13+,21-15+,23-16+,25-17+,26-18+,30-19+,31-20+,32-22+,33-24+,34-27+/t39-,40-,41+,42-,44+/m1/s1
InChIKey UZEDMSSSHUUMFP-YLKNCTOASA-N
Mol Weight 793.0 g/mol
Molecular Formula C45H60O12
Exact Mass 792.408477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6nkUc6NM1g2
Name UZEDMSSSHUUMFP-YLKNCTOASA-N
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H60O12
InChI InChI=1S/C45H60O12/c1-30(19-13-14-20-31(2)25-17-27-34(5)43(50)51-12)21-15-22-32(3)23-16-24-33(4)26-18-28-45(10,11)57-44-42(55-38(9)49)41(54-37(8)48)40(53-36(7)47)39(56-44)29-52-35(6)46/h13-27,39-42,44H,28-29H2,1-12H3/b14-13+,21-15+,23-16+,25-17+,26-18+,30-19+,31-20+,32-22+,33-24+,34-27+/t39-,40-,41+,42-,44+/m1/s1
InChIKey UZEDMSSSHUUMFP-YLKNCTOASA-N
Literature Reference Author K.SHINDO,M.ENDO,Y.MIYAKE,K.WAKASUGI,D.MORRITT,P.M.BRAMLEY,P. D.FRASER,H.KASAI,N.M
Literature Reference Citation J.ANTIBIOTICS,61,729(2008)
Literature Reference DOI 10.1038/ja.2008.86
Molecular Weight 792.964 g/mol
Solvent CDCl3
Source File Reference UWMB389