Dataset

Piperine[3]

This dataset contains NMR spectra obtained for the sample containing Piperine

InChI	InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+
SMILES	O=C(/C=C/C=C/C1=CC2=C(C=C1)OCO2)N1CCCCC1
InChI Key	MXXWOMGUGJBKIW-YPCIICBESA-N
Molecular Formula	C17H19NO3
Exact Mass	285.340 g/mol

Data and Resources

Field	Value
DOI	10.57992/nmrxiv.p42.s1326.d5849
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D5849
Version
Author	Peter Spiteller
Maintainer
Language	english
MetadataPublished	2025-08-31T17:42:30.000000Z
Related Molecule

Field	Value
Measurement Technique
Measurement Variables	NMR solvent : acquisition nucleus : NMR spectrum by dimensionality : NMR probe : Temperature : K magnetic field strength : Tesla number of scans : scans nuclear magnetic resonance pulse sequence : Spectral Width : number of data points : points relaxation time measurement : seconds

Data-Source Molecule ID	Data-Source
DB12582	drugbank
CHEBI:28821	chebi
AYR	rcsb_pdb
CHEMBL43185	chembl
29358781	surechembl
94058	surechembl
638024	pubchem
U71XL721QK	fdasrs
AYR	pdbe
PD001540	probes_and_drugs
PIPINE	CCDC
179890	brenda
20806	brenda
45695	brenda
HMDB0029377	hmdb
DTXSID3021805	comptox
NCT01383694	clinicaltrials
NCT01893424	clinicaltrials
NCT02598726	clinicaltrials
NCT03201835	clinicaltrials
NCT04731844	clinicaltrials
NCT05430087	clinicaltrials
NCT06063486	clinicaltrials
Molport-001-759-210	molport
50148573	bindingdb
The data in this table is sourced from UniChem at EBI.