Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C24H26N4O6S2 |
| Molecular Weight | 530.616 |
| Optical Activity | ( + ) |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C1=CC(NC(=O)[C@@H]2C[C@@H](CN2)SS[C@@H]3CN[C@@H](C3)C(=O)NC4=CC=CC(=C4)C(O)=O)=CC=C1
InChI
InChIKey=OUYXUDFSSQPGIH-MUGJNUQGSA-N
InChI=1S/C24H26N4O6S2/c29-21(27-15-5-1-3-13(7-15)23(31)32)19-9-17(11-25-19)35-36-18-10-20(26-12-18)22(30)28-16-6-2-4-14(8-16)24(33)34/h1-8,17-20,25-26H,9-12H2,(H,27,29)(H,28,30)(H,31,32)(H,33,34)/t17-,18-,19-,20-/m0/s1
| Molecular Formula | C24H26N4O6S2 |
| Molecular Weight | 530.616 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 4 / 4 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 18:27:26 GMT 2025
by
admin
on
Wed Apr 02 18:27:26 GMT 2025
|
| Record UNII |
HT4NCS6B4Q
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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734527-79-8
Created by
admin on Wed Apr 02 18:27:26 GMT 2025 , Edited by admin on Wed Apr 02 18:27:26 GMT 2025
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71750016
Created by
admin on Wed Apr 02 18:27:26 GMT 2025 , Edited by admin on Wed Apr 02 18:27:26 GMT 2025
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HT4NCS6B4Q
Created by
admin on Wed Apr 02 18:27:26 GMT 2025 , Edited by admin on Wed Apr 02 18:27:26 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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![Structure of 3-[(2S,4S)-4-{[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]disulfanyl}pyrrolidine-2-amido]benzoic acid dihydrochloride](/img/982e1063-9a4e-45a9-a464-8d0c362d7b12.svg "Structure of 3-[(2S,4S)-4-{[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]disulfanyl}pyrrolidine-2-amido]benzoic acid dihydrochloride")