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1-N-[(S)-4-AMINO-2-HYDROXYBUTANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE
SpectraBase Compound ID HOkWVeClVUT
InChI InChI=1S/C22H47N7O8/c23-4-1-2-6-28-7-8-35-20-12(29-21(34)13(30)3-5-24)9-11(26)19(18(20)33)37-22-15(27)17(32)16(31)14(10-25)36-22/h11-20,22,28,30-33H,1-10,23-27H2,(H,29,34)/t11-,12+,13+,14+,15+,16+,17+,18-,19+,20-,22+/m0/s1
InChIKey QRCUUUGDKXULRN-PBJZLXFWSA-N
Mol Weight 537.7 g/mol
Molecular Formula C22H47N7O8
Exact Mass 537.348611 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H82Cb9ubqMu
Name 1-N-[(S)-4-AMINO-2-HYDROXYBUTANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H47N7O8
InChI InChI=1S/C22H47N7O8/c23-4-1-2-6-28-7-8-35-20-12(29-21(34)13(30)3-5-24)9-11(26)19(18(20)33)37-22-15(27)17(32)16(31)14(10-25)36-22/h11-20,22,28,30-33H,1-10,23-27H2,(H,29,34)/t11-,12+,13+,14+,15+,16+,17+,18-,19+,20-,22+/m0/s1
InChIKey QRCUUUGDKXULRN-PBJZLXFWSA-N
Literature Reference Author J.HADDAD,L.P.KOTRA,B.LLANO-SOTELO,C.KIM,E.F.AZUCENA,M.LIU,S. B.VAKULENKO,C.S.CHOW
Literature Reference Citation J.AM.CHEM.SOC.,124,3229(2002)
Literature Reference DOI 10.1021/ja011695m
Molecular Weight 537.657 g/mol
Sample ID 33654
Solvent D2O