Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
InChI | InChI=1S/C30H36N6O4/c1-2-3-13-34-19-27(37)33-25(15-22-17-32-24-10-5-4-9-23(22)24)29(39)35(18-21-8-6-12-31-16-21)20-28(38)36-14-7-11-26(36)30(34)40/h4-6,8-10,12,16-17,25-26,32H,2-3,7,11,13-15,18-20H2,1H3,(H,33,37)/t25-,26+/m0/s1 |
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SMILES | CCCCN1CC(=O)N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N(CC(=O)N2[C@@H](C1=O)CCC2)Cc1cccnc1 |
InChI Key | NVXGXPMKNKTPGN-IZZNHLLZSA-N |
Molecular Formula | C30H36N6O4 |
Exact Mass | 544.645 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/NVXGXPMKNKTPGN-IZZNHLLZSA-N/CHMO0001146 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/NVXGXPMKNKTPGN-IZZNHLLZSA-N/CHMO0001146 |
Version | |
Author | Claudine Herlan |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T05:02:09.394031 |
MetadataModified | 2024-09-07T20:24:05.231602 |
MetadataPublished | 2021-09-23 |
Field | Value |
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Measurement Technique | 1H–13C heteronuclear single quantum coherence |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |