Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C21H23NO5S |
| Molecular Weight | 401.476 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(OC)C(OC)=C2C(CCC(NC=O)C3=CC(=O)C(SC)=CC=C23)=C1
InChI
InChIKey=QWMGUEXZTDFFTR-UHFFFAOYSA-N
InChI=1S/C21H23NO5S/c1-25-17-9-12-5-7-15(22-11-23)14-10-16(24)18(28-4)8-6-13(14)19(12)21(27-3)20(17)26-2/h6,8-11,15H,5,7H2,1-4H3,(H,22,23)
| Molecular Formula | C21H23NO5S |
| Molecular Weight | 401.476 |
| 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
Wed Apr 02 19:21:35 GMT 2025
by
admin
on
Wed Apr 02 19:21:35 GMT 2025
|
| Record UNII |
KB446N4P3S
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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KB446N4P3S
Created by
admin on Wed Apr 02 19:21:35 GMT 2025 , Edited by admin on Wed Apr 02 19:21:35 GMT 2025
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PRIMARY | |||
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341279
Created by
admin on Wed Apr 02 19:21:35 GMT 2025 , Edited by admin on Wed Apr 02 19:21:35 GMT 2025
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906439-61-0
Created by
admin on Wed Apr 02 19:21:35 GMT 2025 , Edited by admin on Wed Apr 02 19:21:35 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> RACEMATE |
|
![Structure of N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide](/img/a1e2c514-9bf7-4236-9655-e3b2f453009d.svg "Structure of N-[(7S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo[a]heptalen-7-yl]formamide")