Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Info

molecular Image
InChI InChI=1S/C30H41N5O5/c1-40-16-8-14-33-19-27(36)32-25(17-21-18-31-24-12-6-5-11-23(21)24)29(38)35(22-9-3-2-4-10-22)20-28(37)34-15-7-13-26(34)30(33)39/h5-6,11-12,18,22,25-26,31H,2-4,7-10,13-17,19-20H2,1H3,(H,32,36)/t25-,26+/m0/s1
SMILES COCCCN1CC(=O)N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N(CC(=O)N2[C@@H](C1=O)CCC2)C1CCCCC1
InChI Key UMUQNEUURUITIQ-IZZNHLLZSA-N
Molecular Formula C30H41N5O5
Exact Mass 551.677 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UMUQNEUURUITIQ-IZZNHLLZSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/UMUQNEUURUITIQ-IZZNHLLZSA-N/CHMO0001150
Version
Author Claudine Herlan
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-09-23
Related Molecule
  • (6S,12R)-4-cyclohexyl-6-(1H-indol-3-ylmethyl)-10-(3-methoxypropyl)-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    156599653 PubChem
    The data in this table is sourced from UniChem at EBI.