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10,19-DIACETYL-SPHINXOLIDE;36-((E)-N-FORMYL-N-METHYLAMINO)-10,19-DIACETOXY-7,8,13,15,21,27,33-HEPTAMETHOXY-5,12,18,24,26,28,32-HEPTAMETHYL-31-OXO-11,9-(2-OXO-1
SpectraBase Compound ID KLaZUxXigcZ
InChI InChI=1S/C58H91NO17/c1-35-20-18-22-52(64)75-55(41(7)54(71-16)37(3)25-28-47(63)39(5)48(68-13)21-19-29-59(10)34-60)38(4)24-27-44(66-11)31-49(73-42(8)61)36(2)23-26-45(67-12)32-50(69-14)40(6)56-58(74-43(9)62)46(33-53(65)76-56)57(72-17)51(30-35)70-15/h18-20,22-24,26-27,29,33-34,36-41,44-45,48-51,54-58H,21,25,28,30-32H2,1-17H3/b22-18-,26-23-,27-24-,29-19+,35-20-/t36?,37?,38?,39?,40?,41?,44?,45?,48?,49?,50?,51?,54?,55?,56-,57?,58-/m1/s1
InChIKey GITCZLJCEKHVHK-XLBKBDHASA-N
Mol Weight 1074.4 g/mol
Molecular Formula C58H91NO17
Exact Mass 1073.6287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ColC6QsTag6
Name 10,19-DIACETYL-SPHINXOLIDE;36-((Z)-N-FORMYL-N-METHYLAMINO)-10,19-DIACETOXY-7,8,13,15,21,27,33-HEPTAMETHOXY-5,12,18,24,26,28,32-HEPTAMETHYL-31-OXO-11,9-(2-OXO-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H91NO17
InChI InChI=1S/C58H91NO17/c1-35-20-18-22-52(64)75-55(41(7)54(71-16)37(3)25-28-47(63)39(5)48(68-13)21-19-29-59(10)34-60)38(4)24-27-44(66-11)31-49(73-42(8)61)36(2)23-26-45(67-12)32-50(69-14)40(6)56-58(74-43(9)62)46(33-53(65)76-56)57(72-17)51(30-35)70-15/h18-20,22-24,26-27,29,33-34,36-41,44-45,48-51,54-58H,21,25,28,30-32H2,1-17H3/b22-18-,26-23-,27-24-,29-19+,35-20-/t36?,37?,38?,39?,40?,41?,44?,45?,48?,49?,50?,51?,54?,55?,56-,57?,58-/m1/s1
InChIKey GITCZLJCEKHVHK-XLBKBDHASA-N
Literature Reference Author G.GUELLA,I.MANCINI,G.CHIASERA,F.PIETRA
Literature Reference Citation HELV.CHIM.ACTA,72,237(1989)
Literature Reference DOI 10.1002/hlca.19890720207
Molecular Weight 1074.357 g/mol
Solvent CDCl3
Source File Reference UWCS12803