Dataset

distortionless enhancement with polarization transfer (DEPT)

dataset for distortionless enhancement with polarization transfer (DEPT)

Chemical Information

molecular Image
InChI InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H
SMILES O=Cc1ccco1
InChI Key HYBBIBNJHNGZAN-UHFFFAOYSA-N
Molecular Formula C5H4O2
Exact Mass 96.084 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HYBBIBNJHNGZAN-UHFFFAOYSA-N/CHMO0000596
License URL
Source https://www.chemotion-repository.net/inchikey/HYBBIBNJHNGZAN-UHFFFAOYSA-N/CHMO0000596
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-07-01
Related Molecule
  • furan-2-carbaldehyde
    • Field Value
    Measurement Technique distortionless enhancement with polarization transfer
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB16856 drugbank
    FU2 rcsb_pdb
    CHEMBL189362 chembl
    20439 surechembl
    7362 pubchem
    DJ1HGI319P fdasrs
    CHEBI:34768 rhea
    PD124142 probes_and_drugs
    ZOGQEU CCDC
    106107 brenda
    11498 brenda
    123759 brenda
    140092 brenda
    148305 brenda
    20597 brenda
    21604 brenda
    32223 brenda
    49066 brenda
    5969 brenda
    6118 brenda
    91034 brenda
    95728 brenda
    FU2 - Ideal conformer pdbe
    HMDB0032914 hmdb
    Molport-000-871-210 molport
    50486229 bindingdb
    The data in this table is sourced from UniChem at EBI.