@prefix adms: <http://www.w3.org/ns/adms#> .
@prefix bfo: <http://purl.obolibrary.org/obo/BFO_> .
@prefix chebi: <http://purl.obolibrary.org/obo/CHEBI_> .
@prefix cheminf: <http://semanticscience.org/resource/CHEMINF_> .
@prefix chmo: <http://purl.obolibrary.org/obo/CHMO_> .
@prefix dcat: <http://www.w3.org/ns/dcat#> .
@prefix dcatap: <http://data.europa.eu/r5r/> .
@prefix dct: <http://purl.org/dc/terms/> .
@prefix foaf: <http://xmlns.com/foaf/0.1/> .
@prefix prov: <http://www.w3.org/ns/prov#> .
@prefix schema1: <http://schema.org/> .
@prefix sio: <http://semanticscience.org/resource/SIO_> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix xsd: <http://www.w3.org/2001/XMLSchema#> .

<https://doi.org/10.57992/nmrxiv.p67.s501.d2471> a dcat:Dataset ;
    dcatap:applicableLegislation <https://creativecommons.org/licenses/by-sa/4.0/legalcode> ;
    dct:conformsTo [ a dct:Standard ;
            dct:description "https://w3id.org/nfdi-de/dcat-ap-plus/chemistry/" ;
            dct:title "ChemDCAT-AP" ] ;
    dct:creator [ a foaf:Agent ;
            dct:type [ a skos:Concept ;
                    dct:description "A human being." ;
                    skos:prefLabel "person" ] ;
            foaf:name "Fang HQ" ],
        [ a foaf:Agent ;
            dct:type [ a skos:Concept ;
                    dct:description "A human being." ;
                    skos:prefLabel "person" ] ;
            foaf:name "Liu JZ" ],
        [ a foaf:Agent ;
            dct:type [ a skos:Concept ;
                    dct:description "A human being." ;
                    skos:prefLabel "person" ] ;
            foaf:name "Wang YD" ],
        [ a foaf:Agent ;
            dct:type [ a skos:Concept ;
                    dct:description "A human being." ;
                    skos:prefLabel "person" ] ;
            foaf:name "Sun GB" ],
        [ a foaf:Agent ;
            dct:type [ a skos:Concept ;
                    dct:description "A human being." ;
                    skos:prefLabel "person" ] ;
            foaf:name "Ding G" ] ;
    dct:description "This dataset contains NMR spectra obtained for the sample -317E-11 isFt: true name: PROTON_01.fid phc0: 138.855499268 isFid: false nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 599.687849862 spectralWidth: 17.969118553060127 numberOfPoints: 21552 frequencyOffset: 4197.837999981857 originFrequency: 599.6920477 isFt: true name: PROTON_02.fid phc0: 129.647903442 isFid: false nucleus: 1H solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 599.687849862 spectralWidth: 17.969118553060127 numberOfPoints: 21552 frequencyOffset: 4197.837999981857 originFrequency: 599.6920477 date: 2023-06-06T03:35:18.000Z isFt: true name: 317E-11/7 phc0: -41.40093 phc1: 29.7281 type: NMR Spectrum DECIM: 2000 aqMod: 3 isFid: false tdOff: 0 title: Parameter file, TopSpin 3.5 pl 7 DSPFVS: 20 nucleus: 1H reverse: false solvent: DMSO_D6 dimension: 1 increment: 2.856834316751186 isComplex: true probeName: Z125869_0013 (CPP BBO 500S1 BB-H&F-D-05 Z) experiment: 1d groupDelay: 67.9862518310547 temperature: 297.9947 spectrumSize: 65536 baseFrequency: 500.05 fieldStrength: 11.744471899400196 numberOfScans: 16 pulseSequence: zg30 spectralWidth: 19.9978402172583 numberOfPoints: 8 relaxationTime: 1 acquisitionTime: 0.00034999999999999935 frequencyOffset: 4000.399999995352 originFrequency: 500.0540004 pulseStrength90: 20833.333333333332 experimentNumber: 7 linearPredictionBin: 0 lpNumberOfCoefficients: 0 windowMultiplicationMode: 1 isFt: true name: CARBON_01.fid phc0: 127.851055633 isFid: false nucleus: 13C solvent: cdcl3 dimension: 1 isComplex: true temperature: 25 baseFrequency: 150.791629785 spectralWidth: 251.19953894528433 numberOfPoints: 32768 frequencyOffset: 16587.11499999299 originFrequency: 150.8082169" ;
    dct:identifier "https://doi.org/10.57992/nmrxiv.p67.s501.d2471" ;
    dct:issued "2025-02-03"^^xsd:date ;
    dct:language [ a dct:LinguisticSystem ;
            dct:description "http://id.loc.gov/vocabulary/iso639-1/en" ;
            dct:title "en" ] ;
    dct:modified "2026-01-03"^^xsd:date ;
    dct:publisher [ a foaf:Agent ;
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                    dct:description "http://purl.org/adms/publishertype/Academia-ScientificOrganisation" ;
                    skos:prefLabel "Academia/Scientific organisation" ] ;
            foaf:name "nmrXiv" ] ;
    dct:subject <https://doi.org/10.57992/nmrxiv.p67.s501.d2471#sample> ;
    dct:title "317E-11[7]" ;
    adms:identifier [ a adms:Identifier ;
            dct:description "The id of this dataset within the NFDI4Chem Search Service (https://search.nfdi4chem.de/)" ;
            dct:title "Search Service ID" ;
            skos:notation "https://search.nfdi4chem.de/dataset/nmrxiv-d2471" ],
        [ a adms:Identifier ;
            dct:description "The DOI of this dataset" ;
            dct:title "DOI" ;
            skos:notation "10.57992/nmrxiv.p67.s501.d2471" ] ;
    dcat:landingPage <https://nmrxiv.org/D2471> ;
    prov:wasGeneratedBy <https://doi.org/10.57992/nmrxiv.p67.s501.d2471#measurement> .

chmo:0000593 a schema1:DefinedTerm ;
    schema1:name "1H nuclear magnetic resonance spectroscopy" .

<https://creativecommons.org/licenses/by-sa/4.0/legalcode> a <http://data.europa.eu/eli/ontology#LegalResource> ;
    dct:title "Attribution-ShareAlike 4.0 International" .

<https://doi.org/10.57992/nmrxiv.p67.s501.d2471#measurement> a chmo:0000593,
        prov:Activity ;
    dct:description "The kind of activity/process used to generate the dataset" ;
    prov:used <https://doi.org/10.57992/nmrxiv.p67.s501.d2471#sample> .

<https://doi.org/10.57992/nmrxiv.p67.s501.d2471#sample_compound> a chebi:23367 ;
    sio:000008 [ a cheminf:000113 ;
            dct:title "assigned InChI" ;
            prov:value "InChI=1S/C32H33N7O6S4/c1-17-29(26(43)33-2)15-30(20-10-6-7-11-21(20)35-25(30)39(29)24(42)23(41)34-17)38-14-18(19-9-5-8-12-22(19)38)13-31-27(44)37(4)32(16-40,28(45)36(31)3)49(31)48-47-46/h5-12,14,17,25,35,40H,13,15-16H2,1-4H3,(H,33,43)(H,34,41)/t17-,25+,29-,30-,31-,32-,49?/m0/s1" ],
        [ a cheminf:000018 ;
            dct:title "assigned SMILES" ;
            prov:value "CNC(=O)[C@@]12C[C@]3(N4C=C(C[C@]56C(=O)N(C)[C@](CO)(C(=O)N5C)S6=S=S=S)C5=CC=CC=C54)C4=C(C=CC=C4)N[C@@H]3N1C(=O)C(=O)N[C@H]2C" ],
        [ a cheminf:000059 ;
            dct:title "assigned InChIKey" ;
            prov:value "ZBOUYSDUWJGEFC-CAPSNEHASA-N" ] .

<https://nmrxiv.org/D2471> a foaf:Document .

<https://doi.org/10.57992/nmrxiv.p67.s501.d2471#sample> a sio:001378 ;
    bfo:0000051 <https://doi.org/10.57992/nmrxiv.p67.s501.d2471#sample_compound> ;
    dct:title "evaluated sample" .