Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C27H28N2.C4H4O4 |
Molecular Weight | 877.1214 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN1CCC(CC1)=C2C3=C(CN(CC4=CC=CC=C4)C5=C2C=CC=C5)C=CC=C3.CN6CCC(CC6)=C7C8=C(CN(CC9=CC=CC=C9)C%10=C7C=CC=C%10)C=CC=C8
InChI
InChIKey=ICJKKMBOQGFTRB-KSBRXOFISA-N
InChI=1S/2C27H28N2.C4H4O4/c2*1-28-17-15-22(16-18-28)27-24-12-6-5-11-23(24)20-29(19-21-9-3-2-4-10-21)26-14-8-7-13-25(26)27;5-3(6)1-2-4(7)8/h2*2-14H,15-20H2,1H3;1-2H,(H,5,6)(H,7,8)/b;;2-1-
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 |
Molecular Formula | C27H28N2 |
Molecular Weight | 380.5246 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:18:25 GMT 2023
by
admin
on
Sat Dec 16 14:18:25 GMT 2023
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Record UNII |
413QQF016A
|
Record Status |
Validated (UNII)
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Record Version |
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6444987
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413QQF016A
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DTXSID801340164
Created by
admin on Sat Dec 16 14:18:25 GMT 2023 , Edited by admin on Sat Dec 16 14:18:25 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |