infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/BHYAUNHYQIYLTH-GHMGYCISSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
| InChI | InChI=1S/C56H66N10O10/c57-47(67)27-25-39-49(69)61-41(31-35-15-5-1-6-16-35)51(71)63-43(33-37-19-9-3-10-20-37)55(75)65-29-13-24-46(65)54(74)60-40(26-28-48(58)68)50(70)62-42(32-36-17-7-2-8-18-36)52(72)64-44(34-38-21-11-4-12-22-38)56(76)66-30-14-23-45(66)53(73)59-39/h1-12,15-22,39-46H,13-14,23-34H2,(H2,57,67)(H2,58,68)(H,59,73)(H,60,74)(H,61,69)(H,62,70)(H,63,71)(H,64,72)/t39-,40?,41-,42-,43-,44-,45+,46+/m0/s1 |
|---|---|
| SMILES | NC(=O)CCC1NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H]2N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1ccccc1)Cc1ccccc1)CCC2)CCC(=O)N |
| InChI Key | BHYAUNHYQIYLTH-GHMGYCISSA-N |
| Molecular Formula | C56H66N10O10 |
| Exact Mass | 1039.184 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 | 91622612-5a6b-4480-8544-befc09e2b853 |
| Package id | 10-14272-bhyaunhyqiylth-ghmgycissa-n-ir |
| Resource type | HTML |
| State | active |