Dataset

high-performance liquid chromatography (HPLC)

dataset for high-performance liquid chromatography (HPLC)

Chemical Information

molecular Image
InChI InChI=1S/C51H57N7O6/c52-28-16-17-29-55-36-47(60)57(33-42-24-12-4-13-25-42)38-49(62)58(34-43-26-14-5-15-27-43)37-48(61)56(32-41-22-10-3-11-23-41)35-46(59)53-44(30-39-18-6-1-7-19-39)50(63)54-45(51(55)64)31-40-20-8-2-9-21-40/h1-15,18-27,44-45H,16-17,28-38,52H2,(H,53,59)(H,54,63)/t44-,45-/m0/s1
SMILES NCCCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(Cc2ccccc2)CC(=O)N(CC(=O)N[C@H](C(=O)N[C@H](C1=O)Cc1ccccc1)Cc1ccccc1)Cc1ccccc1
InChI Key LVXXEPHCGCIRKW-GSVOJQHPSA-N
Molecular Formula C51H57N7O6
Exact Mass 864.042 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LVXXEPHCGCIRKW-GSVOJQHPSA-N/CHMO0001009
License URL
Source https://www.chemotion-repository.net/inchikey/LVXXEPHCGCIRKW-GSVOJQHPSA-N/CHMO0001009
Version
Author Claudine Herlan
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-05-26
Related Molecule
  • (3S,6S)-1-(4-aminobutyl)-3,6,10,13,16-pentabenzyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone
    • Field Value
    Measurement Technique high-performance liquid chromatography
    Measurement Variables
    Data-Source Molecule ID Data-Source
    155919828 PubChem
    The data in this table is sourced from UniChem at EBI.