liquid chromatography-mass spectrometry (LCMS) ()
URL: https://doi.org/10.14272/OSJUMAZEBBEMPZ-GSVOJQHPSA-N/CHMO0000524
Dataset description:
dataset for liquid chromatography-mass spectrometry (LCMS)
Chemical Info
InChI | InChI=1S/C51H55Cl2N7O6/c52-42-22-18-40(19-23-42)31-58-33-46(61)55-44(28-37-12-4-1-5-13-37)50(65)56-45(29-38-14-6-2-7-15-38)51(66)57(27-11-10-26-54)34-47(62)60(32-41-20-24-43(53)25-21-41)36-49(64)59(35-48(58)63)30-39-16-8-3-9-17-39/h1-9,12-25,44-45H,10-11,26-36,54H2,(H,55,61)(H,56,65)/t44-,45-/m0/s1 |
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SMILES | NCCCCN1CC(=O)N(Cc2ccc(Cl)cc2)CC(=O)N(Cc2ccccc2)CC(=O)N(Cc2ccc(Cl)cc2)CC(O)=N[C@@H](Cc2ccccc2)C(O)=N[C@@H](Cc2ccccc2)C1=O |
InChI Key | OSJUMAZEBBEMPZ-GSVOJQHPSA-N |
Molecular Formula | C51H55Cl2N7O6 |
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Additional Information
Field | Value |
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Data last updated | unknown |
Metadata last updated | April 13, 2024 |
Created | unknown |
Format | HTML |
License | Attribution 4.0 International (CC BY 4.0) |
Created | 1 month ago |
Id | f68448ad-e7b3-461e-aa3e-96c97e07713d |
Package id | 10-14272-osjumazebbempz-gsvojqhpsa-n-chmo0000524 |
Resource type | HTML |
State | active |