Dataset

Ohauamine B CD3OD.hmbc

Chemical Info

molecular Image
InChI InChI=1S/C17H19N3O4/c1-10(2)17-14(22)19-16(8-11-6-4-3-5-7-11)15(23)24-9-12(20(16)17)13(21)18-17/h3-7,10,12H,8-9H2,1-2H3,(H,18,21)(H,19,22)/t12-,16+,17+/m0/s1
SMILES CC(C)[C@]12NC(=O)[C@@H]3COC(=O)[C@](CC4=CC=CC=C4)(NC1=O)N32
InChI Key HPYWWARXLJUROF-JCURWCKSSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p87.s735.d3641
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D3641
Version
Author
Maintainer
Language english
MetadataCreated 2025-02-03T17:02:04.513371
MetadataModified 2025-02-03T17:02:04.513379
MetadataPublished 2024-12-19 01:06:40
Related Molecule
  • nfdi4chem-mol2919 (Unknown Molecule)
    • Field Value
    Measurement Technique heteronuclear multiple bond coherence
    Measurement Variables
    NMR solvent : MeOD

    acquisition nucleus : 1H , 13C

    NMR spectrum by dimensionality : 2

    NMR probe : Z44896_0057 (CP TCI 600S3 H-C/N-D-05 Z)

    Temperature : 293.0013 K

    irradiation frequency : 600.17 MHz , 150.912866534 MHz

    magnetic field strength : 14.095949804745555 Tesla

    number of scans : 40 scans

    nuclear magnetic resonance pulse sequence : hmbcgplpndqf

    Spectral Width : 19.8355505627572 , 188

    number of data points : 14 points

    relaxation time measurement : 1 seconds

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.