Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C25H33N5O5/c1-14(2)10-19-25(35)30-9-5-8-21(30)24(34)29-20(13-31)23(33)27-18(22(32)28-19)11-15-12-26-17-7-4-3-6-16(15)17/h3-4,6-7,12,14,18-21,26,31H,5,8-11,13H2,1-2H3,(H,27,33)(H,28,32)(H,29,34)/t18-,19-,20-,21+/m0/s1
SMILES OC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]c2c1cccc2)CC(C)C
InChI Key GUYNEJRKDRZDDG-XSDIEEQYSA-N
Molecular Formula C25H33N5O5
Exact Mass 483.560 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GUYNEJRKDRZDDG-XSDIEEQYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/GUYNEJRKDRZDDG-XSDIEEQYSA-N/CHMO0001146
Version
Author Claudine Herlan
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:05:30.798730
MetadataModified 2024-09-07T20:28:27.454209
MetadataPublished 2021-09-23
Field Value
Measurement Technique 1H–13C heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
156599655 PubChem
The data in this table is sourced from UniChem at EBI.