1H--13C heteronuclear single quantum coherence...
URL: https://www.chemotion-repository.net/inchikey/JMNJVTCCUUBZIL-GSVOJQHPSA-N/CHMO0001146
Dataset description:
dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)\n\n
Source: 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
| InChI | InChI=1S/C51H54Cl3N7O6/c52-41-19-13-38(14-20-41)29-59-32-46(62)56-44(27-36-9-3-1-4-10-36)50(66)57-45(28-37-11-5-2-6-12-37)51(67)58(26-8-7-25-55)33-47(63)60(30-39-15-21-42(53)22-16-39)35-49(65)61(34-48(59)64)31-40-17-23-43(54)24-18-40/h1-6,9-24,44-45H,7-8,25-35,55H2,(H,56,62)(H,57,66)/t44-,45-/m0/s1 |
|---|---|
| SMILES | NCCCCN1CC(=O)N(Cc2ccc(cc2)Cl)CC(=O)N(Cc2ccc(cc2)Cl)CC(=O)N(CC(=O)N[C@H](C(=O)N[C@H](C1=O)Cc1ccccc1)Cc1ccccc1)Cc1ccc(cc1)Cl |
| InChI Key | JMNJVTCCUUBZIL-GSVOJQHPSA-N |
| Molecular Formula | C51H54Cl3N7O6 |
| Exact Mass | 967.377 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | c4587294-0341-4390-8196-c005d244c075 |
| Package id | 10-14272-jmnjvtccuubzil-gsvojqhpsa-n-chmo0001146 |
| Resource type | HTML |
| State | active |