Dataset

synthetic peptide amide LDLD.1d

synthetic peptide amide with LDLD configuration dissolved in DMSO-d6 and recorded at 303 K at 600 MHz (1H), 150 MHz (13C)

Chemical Info

molecular Image

InChI	InChI=1S/C26H32N6O7/c27-17(11-15-7-3-1-4-8-15)24(37)31-19(12-16-9-5-2-6-10-16)25(38)32-20(14-22(34)35)26(39)30-18(23(29)36)13-21(28)33/h1-10,17-20H,11-14,27H2,(H2,28,33)(H2,29,36)(H,30,39)(H,31,37)(H,32,38)(H,34,35)/t17-,18+,19+,20-/m0/s1
SMILES	NC(=O)C[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CC1=CC=CC=C1)C(N)=O
InChI Key	CUNFKUBXPYTROU-NMLBUPMWSA-N

Data and Resources

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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p18.s86.d512
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0/legalcode
Source	https://nmrxiv.org/D512
Version
Author
Maintainer
Language	english
MetadataCreated	2024-04-22T16:06:09.747042
MetadataModified	2024-09-23T09:31:40.666987
MetadataPublished	2023-11-30 09:55:03

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	NMR solvent : DMSO acquisition nucleus : ['13C'] NMR spectrum by dimensionality : 1 NMR probe : Z126545_0027 (CPP BBO 600S3 BB-H&F-D-05 Z) Temperature : 303.0003 K magnetic field strength : 14.092007848400833 Tesla number of scans : 2048 scans nuclear magnetic resonance pulse sequence : zgpg30 Spectral Width : 220.868434428197 number of data points : 8 points relaxation time measurement : 2 seconds

Data-Source Molecule ID	Data-Source
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