Dataset

high-performance liquid chromatography (HPLC)

dataset for high-performance liquid chromatography (HPLC)

Chemical Information

molecular Image
InChI InChI=1S/C33H38N6O4/c1-19(2)14-26-30(40)36-27(15-20-17-34-24-10-5-3-8-22(20)24)31(41)38-28(16-21-18-35-25-11-6-4-9-23(21)25)33(43)39-13-7-12-29(39)32(42)37-26/h3-6,8-11,17-19,26-29,34-35H,7,12-16H2,1-2H3,(H,36,40)(H,37,42)(H,38,41)/t26-,27-,28-,29+/m0/s1
SMILES CC(C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]c2c1cccc2)Cc1c[nH]c2c1cccc2)C
InChI Key MQPKONIEQRYHFG-XFTNXAEASA-N
Molecular Formula C33H38N6O4
Exact Mass 582.693 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MQPKONIEQRYHFG-XFTNXAEASA-N/CHMO0001009
License URL
Source https://www.chemotion-repository.net/inchikey/MQPKONIEQRYHFG-XFTNXAEASA-N/CHMO0001009
Version
Author Claudine Herlan
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-09-23
Related Molecule
  • (3S,6S,9S,12R)-3,6-bis(1H-indol-3-ylmethyl)-9-(2-methylpropyl)-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone
    • Field Value
    Measurement Technique high-performance liquid chromatography
    Measurement Variables
    Data-Source Molecule ID Data-Source
    156599651 PubChem
    The data in this table is sourced from UniChem at EBI.