Details
Stereochemistry | ACHIRAL |
Molecular Formula | C28H38N4O.C4H4O4 |
Molecular Weight | 562.6997 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.NC(=O)C1(CCN(CCCN2C3=C(CCC4=C2C=CC=C4)C=CC=C3)CC1)N5CCCCC5
InChI
InChIKey=LQMNVYGQJJRMRR-BTJKTKAUSA-N
InChI=1S/C28H38N4O.C4H4O4/c29-27(33)28(31-18-6-1-7-19-31)15-21-30(22-16-28)17-8-20-32-25-11-4-2-9-23(25)13-14-24-10-3-5-12-26(24)32;5-3(6)1-2-4(7)8/h2-5,9-12H,1,6-8,13-22H2,(H2,29,33);1-2H,(H,5,6)(H,7,8)/b;2-1-
Molecular Formula | C28H38N4O |
Molecular Weight | 446.6275 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:35:36 GMT 2023
by
admin
on
Sat Dec 16 01:35:36 GMT 2023
|
Record UNII |
PT5UOX7GI7
|
Record Status |
Validated (UNII)
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Record Version |
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-
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CHEMBL2110775
Created by
admin on Sat Dec 16 01:35:37 GMT 2023 , Edited by admin on Sat Dec 16 01:35:37 GMT 2023
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5282174
Created by
admin on Sat Dec 16 01:35:37 GMT 2023 , Edited by admin on Sat Dec 16 01:35:37 GMT 2023
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PT5UOX7GI7
Created by
admin on Sat Dec 16 01:35:37 GMT 2023 , Edited by admin on Sat Dec 16 01:35:37 GMT 2023
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100482-23-3
Created by
admin on Sat Dec 16 01:35:37 GMT 2023 , Edited by admin on Sat Dec 16 01:35:37 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |