Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C30H43ClN5O8.Cl |
| Molecular Weight | 672.597 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].COCCOCCOCCOCCOC(=O)OC[N+]1=CC=C(NC(NCCCCCCOC2=CC=C(Cl)C=C2)=NC#N)C=C1
InChI
InChIKey=DAHMXVAETAAQOZ-UHFFFAOYSA-N
InChI=1S/C30H42ClN5O8.ClH/c1-38-16-17-39-18-19-40-20-21-41-22-23-43-30(37)44-25-36-13-10-27(11-14-36)35-29(34-24-32)33-12-4-2-3-5-15-42-28-8-6-26(31)7-9-28;/h6-11,13-14H,2-5,12,15-23,25H2,1H3,(H,33,34);1H
Approval Year
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NCI_THESAURUS |
C274
Created by
admin on Fri Dec 15 17:20:51 UTC 2023 , Edited by admin on Fri Dec 15 17:20:51 UTC 2023
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D6V5QYX9MZ
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9961434
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432037-57-5
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UU-142
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300000034313
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C68931
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CHEMBL1181731
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9145
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DTXSID50962962
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DB05217
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ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
