Details
| Stereochemistry | RACEMIC |
| Molecular Formula | 2C14H18N2O2.H2O4S |
| Molecular Weight | 590.688 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.CC(C)NCC(O)C1=C2C=CC=NC2=C(O)C=C1.CC(C)NCC(O)C3=C4C=CC=NC4=C(O)C=C3
InChI
InChIKey=MDQRJOGEVJBXMW-UHFFFAOYSA-N
InChI=1S/2C14H18N2O2.H2O4S/c2*1-9(2)16-8-13(18)10-5-6-12(17)14-11(10)4-3-7-15-14;1-5(2,3)4/h2*3-7,9,13,16-18H,8H2,1-2H3;(H2,1,2,3,4)
| Molecular Formula | C14H18N2O2 |
| Molecular Weight | 246.3049 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| 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
Mon Mar 31 18:55:56 GMT 2025
by
admin
on
Mon Mar 31 18:55:56 GMT 2025
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| Record UNII |
3PFY85K68G
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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| Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C319
Created by
admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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| Code System | Code | Type | Description | ||
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C152131
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admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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PRIMARY | |||
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23725001
Created by
admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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PRIMARY | |||
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300000055063
Created by
admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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PRIMARY | |||
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13758-23-1
Created by
admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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PRIMARY | |||
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CHEMBL2009119
Created by
admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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PRIMARY | |||
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3PFY85K68G
Created by
admin on Mon Mar 31 18:55:56 GMT 2025 , Edited by admin on Mon Mar 31 18:55:56 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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