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3-FORMYL-RIFAMYCIN-SV;SOLID-STATE
SpectraBase Compound ID J8iIMl6DRuV
InChI InChI=1S/2C38H47NO13/c2*1-16-11-10-12-17(2)37(48)39-28-23(15-40)32(45)25-26(33(28)46)31(44)21(6)35-27(25)36(47)38(8,52-35)50-14-13-24(49-9)18(3)34(51-22(7)41)20(5)30(43)19(4)29(16)42/h2*10-16,18-20,24,29-30,34,42-46H,1-9H3,(H,39,48)/b2*11-10+,14-13+,17-12-/t2*16-,18+,19-,20+,24-,29-,30+,34+,38-/m00/s1
InChIKey FITFHCRCOUWDAJ-KCLIVZLVSA-N
Mol Weight 1451.6 g/mol
Molecular Formula C76H94N2O26
Exact Mass 1450.609481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GhnzLlCTcrd
Name 3-FORMYL-RIFAMYCIN-SV;SOLID-STATE
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C76H94N2O26
InChI InChI=1S/2C38H47NO13/c2*1-16-11-10-12-17(2)37(48)39-28-23(15-40)32(45)25-26(33(28)46)31(44)21(6)35-27(25)36(47)38(8,52-35)50-14-13-24(49-9)18(3)34(51-22(7)41)20(5)30(43)19(4)29(16)42/h2*10-16,18-20,24,29-30,34,42-46H,1-9H3,(H,39,48)/b2*11-10+,14-13+,17-12-/t2*16-,18+,19-,20+,24-,29-,30+,34+,38-/m00/s1
InChIKey FITFHCRCOUWDAJ-KCLIVZLVSA-N
Literature Reference Author P.PRZYBYLSKI,K.PYTA,K.KLICH,W.SCHILF,B.KAMIENSKI
Literature Reference Citation MAGN.RES.CHEM.,52,10(2014)
Literature Reference DOI 10.1002/mrc.4028
Molecular Weight 1451.580 g/mol
Solvent Unknown
Source File Reference UWBT15707