Dataset

liquid chromatography-mass spectrometry (LCMS) ()

Chemical Info

InChI	InChI=1S/C56H65Cl2N7O9/c1-56(2,3)74-55(73)60-29-13-14-30-62(53(70)47(59)31-40-15-7-4-8-16-40)37-50(67)65(35-44-23-27-46(58)28-24-44)39-52(69)64(33-42-19-11-6-12-20-42)38-51(68)63(34-43-21-25-45(57)26-22-43)36-49(66)61-48(54(71)72)32-41-17-9-5-10-18-41/h4-12,15-28,47-48H,13-14,29-39,59H2,1-3H3,(H,60,73)(H,61,66)(H,71,72)/t47-,48+/m1/s1
SMILES	CC(C)(C)OC(O)=NCCCCN(CC(=O)N(CC(=O)N(CC(=O)N(CC(O)=N[C@@H](Cc1ccccc1)C(=O)O)Cc1ccc(Cl)cc1)Cc1ccccc1)Cc1ccc(Cl)cc1)C(=O)[C@H](N)Cc1ccccc1
InChI Key	NBKXHRCJEFOTBU-QGSYYBFSSA-N
Molecular Formula	C56H65Cl2N7O9

Data and Resources

• liquid chromatography-mass spectrometry (LCMS) ()HTML
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Related Resources

• This dataset related as IsPartOf to https://dx.doi.org/10.14272/NBKXHRCJEFOTBU-QGSYYBFSSA-N.1

• This dataset related as IsPartOf to https://dx.doi.org/10.14272/NBKXHRCJEFOTBU-QGSYYBFSSA-N.1

Metadata Information

• Additional
• Measurement

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source
Version
Author	Akmermer, Kamil
Maintainer	chemotion-repository
Language	en
MetadataCreated	2024-04-13T08:52:37.210122
MetadataModified	2024-04-13T08:52:37.210127
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables