Details
Stereochemistry | RACEMIC |
Molecular Formula | C23H16O6.C21H27ClN2O2 |
Molecular Weight | 763.274 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OCCOCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(Cl)C=C3.OC(=O)C4=CC5=C(C=CC=C5)C(CC6=C7C=CC=CC7=CC(C(O)=O)=C6O)=C4O
InChI
InChIKey=ASDOKGIIKXGMNB-UHFFFAOYSA-N
InChI=1S/C23H16O6.C21H27ClN2O2/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-10,24-25H,11H2,(H,26,27)(H,28,29);1-9,21,25H,10-17H2
Molecular Formula | C23H16O6 |
Molecular Weight | 388.3695 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C21H27ClN2O2 |
Molecular Weight | 374.904 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:17:59 UTC 2023
by
admin
on
Fri Dec 15 16:17:59 UTC 2023
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Record UNII |
M20215MUFR
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29578
Created by
admin on Fri Dec 15 16:17:59 UTC 2023 , Edited by admin on Fri Dec 15 16:17:59 UTC 2023
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Code System | Code | Type | Description | ||
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757063
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1334006
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m6159
Created by
admin on Fri Dec 15 16:17:59 UTC 2023 , Edited by admin on Fri Dec 15 16:17:59 UTC 2023
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PRIMARY | Merck Index | ||
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DTXSID00907580
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SUB02597MIG
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203182
Created by
admin on Fri Dec 15 16:17:59 UTC 2023 , Edited by admin on Fri Dec 15 16:17:59 UTC 2023
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100000085225
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M20215MUFR
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CHEMBL896
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C47560
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10246-75-0
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25096
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M20215MUFR
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DBSALT000984
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233-582-1
Created by
admin on Fri Dec 15 16:17:59 UTC 2023 , Edited by admin on Fri Dec 15 16:17:59 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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SALT/SOLVATE -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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Related Record | Type | Details | ||
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ACTIVE MOIETY |