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ISOVALERYL-L-TYROSYL-L-VALYL-D-TYROSINOL

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ISOVALERYL-L-TYROSYL-L-VALYL-D-TYROSINOL
SpectraBase Compound ID LkndP3iH9I9
InChI InChI=1S/C28H39N3O6/c1-17(2)13-25(35)30-24(15-20-7-11-23(34)12-8-20)27(36)31-26(18(3)4)28(37)29-21(16-32)14-19-5-9-22(33)10-6-19/h5-12,17-18,21,24,26,32-34H,13-16H2,1-4H3,(H,29,37)(H,30,35)(H,31,36)/t21?,24-,26+/m1/s1
InChIKey KKZGSAOHZNZFFH-KGLYDCNGSA-N
Mol Weight 513.6 g/mol
Molecular Formula C28H39N3O6
Exact Mass 513.283886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8UhCLn1RXRR
Name ISOVALERYL-L-TYROSYL-L-VALYL-D-TYROSINOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H39N3O6
InChI InChI=1S/C28H39N3O6/c1-17(2)13-25(35)30-24(15-20-7-11-23(34)12-8-20)27(36)31-26(18(3)4)28(37)29-21(16-32)14-19-5-9-22(33)10-6-19/h5-12,17-18,21,24,26,32-34H,13-16H2,1-4H3,(H,29,37)(H,30,35)(H,31,36)/t21?,24-,26+/m1/s1
InChIKey KKZGSAOHZNZFFH-KGLYDCNGSA-N
Literature Reference Author I.MOMOSE,R.SEKIZAWA,S.HIROSAWA,D.IKEDA,H.NAGANAWA,H.IINUMA,T .TAKEUCHI
Literature Reference Citation J.ANTIBIOTICS,54,1004(2001)
Literature Reference DOI 10.7164/antibiotics.54.1004
Molecular Weight 513.634 g/mol
Solvent CD3OD
Source File Reference UWSI2672