Details
Stereochemistry | ACHIRAL |
Molecular Formula | C22H28N4O4.2C2H4O2 |
Molecular Weight | 532.586 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)=O.CC(O)=O.OCCNCCNC1=CC=C(NCCNCCO)C2=C1C(=O)C3=C(C=CC=C3)C2=O
InChI
InChIKey=IGCAUIJHGNYDKE-UHFFFAOYSA-N
InChI=1S/C22H28N4O4.2C2H4O2/c27-13-11-23-7-9-25-17-5-6-18(26-10-8-24-12-14-28)20-19(17)21(29)15-3-1-2-4-16(15)22(20)30;2*1-2(3)4/h1-6,23-28H,7-14H2;2*1H3,(H,3,4)
Approval Year
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NCI_THESAURUS |
C253
Created by
admin on Fri Dec 15 15:15:36 UTC 2023 , Edited by admin on Fri Dec 15 15:15:36 UTC 2023
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51150
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CHEMBL49442
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R-65
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287513
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C28798
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70711-40-9
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6FH145297U
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admin on Fri Dec 15 15:15:36 UTC 2023 , Edited by admin on Fri Dec 15 15:15:36 UTC 2023
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DTXSID80990970
Created by
admin on Fri Dec 15 15:15:36 UTC 2023 , Edited by admin on Fri Dec 15 15:15:36 UTC 2023
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PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD