Dataset

high-performance liquid chromatography (HPLC)

Chemical Info

InChI	InChI=1S/C45H61N7O6/c1-3-5-25-49-31-40(53)47-38(28-35-18-10-7-11-19-35)44(57)48-39(29-36-20-12-8-13-21-36)45(58)51(27-17-16-24-46)33-43(56)52(30-37-22-14-9-15-23-37)34-42(55)50(26-6-4-2)32-41(49)54/h7-15,18-23,38-39H,3-6,16-17,24-34,46H2,1-2H3,(H,47,53)(H,48,57)/t38-,39-/m0/s1
SMILES	NCCCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(CCCC)CC(=O)N(CC(=O)N[C@H](C(=O)N[C@H](C1=O)Cc1ccccc1)Cc1ccccc1)CCCC
InChI Key	FSURQVKZYDESHV-YDAXCOIMSA-N
Molecular Formula	C45H61N7O6
Exact Mass	796.009 g/mol

Data and Resources

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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/FSURQVKZYDESHV-YDAXCOIMSA-N/CHMO0001009
License URL
Source	https://www.chemotion-repository.net/inchikey/FSURQVKZYDESHV-YDAXCOIMSA-N/CHMO0001009
Version
Author	Claudine Herlan
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:37:59.353787
MetadataModified	2024-09-07T19:53:21.066700
MetadataPublished	2021-05-26

Field	Value
Measurement Technique	high-performance liquid chromatography
Measurement Variables

Data-Source Molecule ID	Data-Source
155919824	PubChem
The data in this table is sourced from UniChem at EBI.