John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=AXc32cNnkWu SpectraBase Spectrum ID=11rTjcjfAX4

(accessed ).
11-AMINO-9-DEOXO-11-DEOXY-9,11-N-NITRILOETHANO-6-O-METHYLERYTHROMYCIN-A-11,12-CYCLIC-CARBAMATE
SpectraBase Compound ID AXc32cNnkWu
InChI InChI=1S/C41H71N3O12/c1-15-28-41(10)33-23(4)30(42-16-17-44(33)38(48)56-41)21(2)19-40(9,50-14)35(55-37-31(45)27(43(11)12)18-22(3)51-37)24(5)32(25(6)36(47)53-28)54-29-20-39(8,49-13)34(46)26(7)52-29/h21-29,31-35,37,45-46H,15-20H2,1-14H3/t21-,22-,23+,24+,25-,26+,27+,28-,29+,31-,32+,33-,34+,35-,37+,39-,40+,41-/m1/s1
InChIKey JBURPRADVIROKC-LDHBAHCXSA-N
Mol Weight 798.0 g/mol
Molecular Formula C41H71N3O12
Exact Mass 797.503775 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11rTjcjfAX4
Name 11-AMINO-9-DEOXO-11-DEOXY-9,11-N-NITRILOETHANO-6-O-METHYLERYTHROMYCIN-A-11,12-CYCLIC-CARBAMATE
Compound Number 1 0A
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H71N3O12
InChI InChI=1S/C41H71N3O12/c1-15-28-41(10)33-23(4)30(42-16-17-44(33)38(48)56-41)21(2)19-40(9,50-14)35(55-37-31(45)27(43(11)12)18-22(3)51-37)24(5)32(25(6)36(47)53-28)54-29-20-39(8,49-13)34(46)26(7)52-29/h21-29,31-35,37,45-46H,15-20H2,1-14H3/t21-,22-,23+,24+,25-,26+,27+,28-,29+,31-,32+,33-,34+,35-,37+,39-,40+,41-/m1/s1
InChIKey JBURPRADVIROKC-LDHBAHCXSA-N
Literature Reference Author M.KASHIMURA,T.ASAKA,Y.MISAWA,K.MATSUMOTO,S.MORIMOTO
Literature Reference Citation J.ANTIBIOTICS,54,664(2001)
Literature Reference DOI 10.7164/antibiotics.54.664
Molecular Weight 798.028 g/mol
Solvent CDCl3
Source File Reference UWSI2040
SpectraBase Batch ID CTSTrbrGqqo