John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=3CsoNGn3YUf SpectraBase Spectrum ID=11O6IxMdSVP

(accessed ).
NK-86-0279-I;44-HOMO-OLIGOMYCIN-B
SpectraBase Compound ID 3CsoNGn3YUf
InChI InChI=1S/C46H74O12/c1-12-33-18-16-14-15-17-26(4)43(53)45(11,55)44(54)32(10)41(52)31(9)40(51)30(8)39(50)25(3)19-22-38(49)56-42-29(7)35(21-20-33)57-46(34(42)13-2)37(48)23-27(5)36(58-46)24-28(6)47/h14-16,18-19,22,25-36,39,41-43,47,50,52-53,55H,12-13,17,20-21,23-24H2,1-11H3/b15-14+,18-16+,22-19+/t25-,26+,27-,28+,29+,30-,31-,32-,33-,34-,35-,36+,39+,41+,42+,43-,45+,46+/m1/s1
InChIKey VVNFPMGPKYNROA-BXJYRYOHSA-N
Mol Weight 819.1 g/mol
Molecular Formula C46H74O12
Exact Mass 818.518028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 11O6IxMdSVP
Name NK-86-0279-I;44-HOMO-OLIGOMYCIN-B
Compound Number 1
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H74O12
InChI InChI=1S/C46H74O12/c1-12-33-18-16-14-15-17-26(4)43(53)45(11,55)44(54)32(10)41(52)31(9)40(51)30(8)39(50)25(3)19-22-38(49)56-42-29(7)35(21-20-33)57-46(34(42)13-2)37(48)23-27(5)36(58-46)24-28(6)47/h14-16,18-19,22,25-36,39,41-43,47,50,52-53,55H,12-13,17,20-21,23-24H2,1-11H3/b15-14+,18-16+,22-19+/t25-,26+,27-,28+,29+,30-,31-,32-,33-,34-,35-,36+,39+,41+,42+,43-,45+,46+/m1/s1
InChIKey VVNFPMGPKYNROA-BXJYRYOHSA-N
Literature Reference Author M.YAMAZAKI,T.YAMASHITA,T.HARADA,T.NISHIKIORI,S.SAITO,N.SHIMA DA,A.FUJII
Literature Reference Citation J.ANTIBIOTICS,45,171(1992)
Literature Reference DOI 10.7164/antibiotics.45.171
Molecular Weight 819.086 g/mol
Sample ID 45816
Solvent CDCl3
SpectraBase Batch ID 1kuzgik3qMU