)))
New to the Repository? Check the Settings and Preparation guide. Starting your research? Review our How to provide data instructions. Learn more in How-To section, and feel free to reach out via or
Click to enable zooming
This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C27H43N5O5
Canonical SMILES: CCCCN1CC(=O)N(CCCC)CC(=O)N[C@H](C(=O)N[C@H](C1=O)Cc1ccc(cc1)O)CCCCN
InChI: InChI=1S/C27H43N5O5/c1-3-5-15-31-18-24(34)29-22(9-7-8-14-28)26(36)30-23(17-20-10-12-21(33)13-11-20)27(37)32(16-6-4-2)19-25(31)35/h10-13,22-23,33H,3-9,14-19,28H2,1-2H3,(H,29,34)(H,30,36)/t22-,23-/m0/s1
InChIKey: UQZIUPVCJVFEKL-GOTSBHOMSA-N
Exact Mass:
Crosslinks: 
Published on 2021-05-26
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Author: Claudine Herlan1
1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany
Analysis DOI:
Analysis ID:
Datasets