Dataset

Ohauamine D CDCl3.hmbc

Chemical Info

molecular Image
InChI InChI=1S/C19H23N3O4/c1-4-11(2)19-16(24)21-18(10-13-8-6-5-7-9-13)17(25)26-12(3)14(22(18)19)15(23)20-19/h5-9,11-12,14H,4,10H2,1-3H3,(H,20,23)(H,21,24)/t11-,12+,14-,18+,19+/m0/s1
SMILES CC[C@H](C)[C@]12NC(=O)[C@@H]3[C@@H](C)OC(=O)[C@](CC4=CC=CC=C4)(NC1=O)N32
InChI Key OEFZLDAPYSPGDH-WKHVUYTFSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p87.s733.d3624
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D3624
Version
Author
Maintainer
Language english
MetadataCreated 2025-02-03T17:01:10.301220
MetadataModified 2025-02-03T17:01:10.301227
MetadataPublished 2024-12-19 01:06:40
Related Molecule
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
NMR solvent : CDCl3

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 : 30 scans

nuclear magnetic resonance pulse sequence : hmbcgplpndqf

Spectral Width : 19.8355505627572 , 189.999995900611

number of data points : 12 points

relaxation time measurement : 1 seconds

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