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NEUTRAMYCIN-E
SpectraBase Compound ID 8uZCFiWdFUf
InChI InChI=1S/C33H52O13/c1-16-8-11-24(46-32-28(38)23(35)14-18(3)42-32)17(2)9-13-26(36)43-19(4)21(29-25(45-29)12-10-22(16)34)15-41-33-31(40-7)30(39-6)27(37)20(5)44-33/h9-10,12-13,16-21,23-25,27-33,35,37-38H,8,11,14-15H2,1-7H3/b12-10+,13-9+/t16-,17+,18+,19-,20+,21-,23-,24+,25-,27+,28+,29+,30-,31+,32-,33+/m1/s1
InChIKey JFHNJVCGXRRDFC-QMXHYENFSA-N
Mol Weight 656.8 g/mol
Molecular Formula C33H52O13
Exact Mass 656.340792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Xgp7aFrJJz
Name NEUTRAMYCIN-E
CAS Registry Number 610786-47-5
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H52O13
InChI InChI=1S/C33H52O13/c1-16-8-11-24(46-32-28(38)23(35)14-18(3)42-32)17(2)9-13-26(36)43-19(4)21(29-25(45-29)12-10-22(16)34)15-41-33-31(40-7)30(39-6)27(37)20(5)44-33/h9-10,12-13,16-21,23-25,27-33,35,37-38H,8,11,14-15H2,1-7H3/b12-10+,13-9+/t16-,17+,18+,19-,20+,21-,23-,24+,25-,27+,28+,29+,30-,31+,32-,33+/m1/s1
InChIKey JFHNJVCGXRRDFC-QMXHYENFSA-N
Literature Reference Author E.I.GRAZIANI,C.R.OVERK,G.T.CARTER
Literature Reference Citation J.NAT.PROD.,66,1149(2003)
Literature Reference DOI 10.1021/np0301691
Molecular Weight 656.768 g/mol
Solvent CD3OD
Source File Reference UWSP947