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MUCUSAMIDE;(2S,3S,4R,5R,7E,11E)-2-[[(2R)-2-HYDROXYTETRACOSANOYL]-AMINO]-HEPTADECA-7,11-DIENE-1,3,4,5-TETROL
SpectraBase Compound ID AciZr0NySP6
InChI InChI=1S/C41H79NO6/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-38(45)41(48)42-36(35-43)39(46)40(47)37(44)33-31-29-27-25-14-12-10-8-6-4-2/h12,14,29,31,36-40,43-47H,3-11,13,15-28,30,32-35H2,1-2H3,(H,42,48)/b14-12+,31-29+/t36-,37+,38+,39-,40+/m0/s1
InChIKey VQDQZGRQTOBJOZ-ZQHBNEFBSA-N
Mol Weight 682.1 g/mol
Molecular Formula C41H79NO6
Exact Mass 681.590739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ic7C5QYbKSz
Name MUCUSAMIDE;(2S,3S,4R,5R,7E,11E)-2-[[(2R)-2-HYDROXYTETRACOSANOYL]-AMINO]-HEPTADECA-7,11-DIENE-1,3,4,5-TETROL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H79NO6
InChI InChI=1S/C41H79NO6/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-28-30-32-34-38(45)41(48)42-36(35-43)39(46)40(47)37(44)33-31-29-27-25-14-12-10-8-6-4-2/h12,14,29,31,36-40,43-47H,3-11,13,15-28,30,32-35H2,1-2H3,(H,42,48)/b14-12+,31-29+/t36-,37+,38+,39-,40+/m0/s1
InChIKey VQDQZGRQTOBJOZ-ZQHBNEFBSA-N
Literature Reference Author J.J.K.BANKEU,S.A.A.MUSTAFA,A.S.GOJAYEV,B.D.LENTA,D.T.NOUGOUE ,S.A.NGOUELA,K.ASAAD
Literature Reference Citation CHEM.PHARM.BULL.,58,1661(2010)
Literature Reference DOI 10.1248/cpb.58.1661
Molecular Weight 682.081 g/mol
Source File Reference UWBT4049