Dataset

Piperine[6]

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.d5852
License URL	https://creativecommons.org/licenses/by/4.0/legalcode
Source	https://nmrxiv.org/D5852
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
PD001540	probes_and_drugs
PIPINE	CCDC
179890	brenda
20806	brenda
45695	brenda
HMDB0029377	hmdb
410499	bindingdb
410502	bindingdb
50158320	bindingdb
50547680	bindingdb
50547681	bindingdb
50547682	bindingdb
50929630	bindingdb
50929650	bindingdb
50952597	bindingdb
50952598	bindingdb
50980621	bindingdb
50980631	bindingdb
51015593	bindingdb
51189385	bindingdb
51209977	bindingdb
51230055	bindingdb
51292031	bindingdb
51475726	bindingdb
51475727	bindingdb
51489951	bindingdb
Molport-001-759-210	molport
The data in this table is sourced from UniChem at EBI.