Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C25H26N2O7S |
| Molecular Weight | 498.548 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C(O)=O)C1=CC=C(CN(CC2=CC(OCC(O)=O)=CC=C2)S(=O)(=O)C3=CN=CC=C3)C=C1
InChI
InChIKey=JOJLHDZTZBZWSZ-UHFFFAOYSA-N
InChI=1S/C25H26N2O7S/c1-25(2,24(30)31)20-10-8-18(9-11-20)15-27(35(32,33)22-7-4-12-26-14-22)16-19-5-3-6-21(13-19)34-17-23(28)29/h3-14H,15-17H2,1-2H3,(H,28,29)(H,30,31)
| Molecular Formula | C25H26N2O7S |
| Molecular Weight | 498.548 |
| 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 16:42:11 UTC 2023
by
admin
on
Sat Dec 16 16:42:11 UTC 2023
|
| Record UNII |
QX28NXX8UG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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QX28NXX8UG
Created by
admin on Sat Dec 16 16:42:11 UTC 2023 , Edited by admin on Sat Dec 16 16:42:11 UTC 2023
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PRIMARY | |||
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10174435
Created by
admin on Sat Dec 16 16:42:11 UTC 2023 , Edited by admin on Sat Dec 16 16:42:11 UTC 2023
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574759-31-2
Created by
admin on Sat Dec 16 16:42:11 UTC 2023 , Edited by admin on Sat Dec 16 16:42:11 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
IN VITRO
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PARENT -> METABOLITE |
