Details
Stereochemistry | ACHIRAL |
Molecular Formula | C20H25NO.CH4O3S |
Molecular Weight | 391.524 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.OC(CCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChIKey=VNJHUUNVDMYCRH-UHFFFAOYSA-N
InChI=1S/C20H25NO.CH4O3S/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21;1-5(2,3)4/h1-2,4-7,10-13,22H,3,8-9,14-17H2;1H3,(H,2,3,4)
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C20H25NO |
Molecular Weight | 295.4186 |
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
Fri Dec 15 18:44:24 GMT 2023
by
admin
on
Fri Dec 15 18:44:24 GMT 2023
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Record UNII |
AQ4K0AJT6G
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Record Status |
Validated (UNII)
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Record Version |
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-
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AQ4K0AJT6G
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SUB04036MIG
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DTXSID40218667
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m9129
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229-953-2
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6856-31-1
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C009185
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165542
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CHEMBL404215
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |