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APOPTOLIDIN
SpectraBase Compound ID 7D37laUoOPc
InChI InChI=1S/C58H96O21/c1-29-17-16-18-40(59)43(69-13)25-45(76-55(65)33(5)23-31(3)21-30(2)22-32(4)41(20-19-29)77-56-51(63)50(62)52(71-15)37(9)74-56)53(64)58(67)35(7)48(60)34(6)42(79-58)24-39(28-68-12)75-47-27-57(11,66)54(38(10)73-47)78-46-26-44(70-14)49(61)36(8)72-46/h17,19-23,32,34-54,56,59-64,66-67H,16,18,24-28H2,1-15H3/b20-19+,29-17+,30-22+,31-21+,33-23+
InChIKey WILMROCKORZEMQ-XUBHXHHRSA-N
Mol Weight 1129.4 g/mol
Molecular Formula C58H96O21
Exact Mass 1128.64441 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 49bzH5OnhXb
Name APOPTOLIDIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H96O21
InChI InChI=1S/C58H96O21/c1-29-17-16-18-40(59)43(69-13)25-45(76-55(65)33(5)23-31(3)21-30(2)22-32(4)41(20-19-29)77-56-51(63)50(62)52(71-15)37(9)74-56)53(64)58(67)35(7)48(60)34(6)42(79-58)24-39(28-68-12)75-47-27-57(11,66)54(38(10)73-47)78-46-26-44(70-14)49(61)36(8)72-46/h17,19-23,32,34-54,56,59-64,66-67H,16,18,24-28H2,1-15H3/b20-19+,29-17+,30-22+,31-21+,33-23+
InChIKey WILMROCKORZEMQ-XUBHXHHRSA-N
Literature Reference Author J.W.KIM,H.ADACHI,K.SHIN-YA,Y.HAYAKAWA,H.SETO
Literature Reference Citation J.ANTIBIOTICS,50,628(1997)
Literature Reference DOI 10.7164/antibiotics.50.628
Molecular Weight 1129.388 g/mol
Solvent CD3OD
Source File Reference UWCS24937