Dataset

high-performance liquid chromatography (HPLC)

Chemical Info

InChI	InChI=1S/C27H40N4O4/c1-4-6-10-15-30-18-23(32)28-21(17-20-12-8-7-9-13-20)25(33)29-24(19(3)5-2)27(35)31-16-11-14-22(31)26(30)34/h7-9,12-13,19,21-22,24H,4-6,10-11,14-18H2,1-3H3,(H,28,32)(H,29,33)/t19?,21-,22+,24-/m0/s1
SMILES	CCCCCN1CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N2[C@@H](C1=O)CCC2)C(CC)C
InChI Key	CDDIRVMOVZNUSI-ILJWHODDSA-N
Molecular Formula	C27H40N4O4
Exact Mass	484.631 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/CDDIRVMOVZNUSI-ILJWHODDSA-N/CHMO0001009
License URL
Source	https://www.chemotion-repository.net/inchikey/CDDIRVMOVZNUSI-ILJWHODDSA-N/CHMO0001009
Version
Author	Claudine Herlan
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T05:06:12.386524
MetadataModified	2024-09-07T20:29:20.907082
MetadataPublished	2021-09-23

Field	Value
Measurement Technique	high-performance liquid chromatography
Measurement Variables

Data-Source Molecule ID	Data-Source
156599661	PubChem
The data in this table is sourced from UniChem at EBI.