Account 4-(5-((3AS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoic acid
- Catalog No. :
- ACFMAL870
- CAS No. :
- 6929-40-4
- Molecular Formula :
- C17H21N3O4S
- Molecular Weight :
- 363.44
IUPAC Name:4-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoic acid
![4-(5-((3AS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 4-(5-((3AS,4S,6aR)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoic acid |
|---|---|
| IUPAC Name | 4-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoic acid |
| Molecular Formula | C17H21N3O4S |
| Molecular Weight | 363.44 |
| SMILES | O=C(O)C1=CC=C(NC(CCCC[C@@H]2SC[C@]([C@]2([H])N3)([H])NC3=O)=O)C=C1 |
| InChI Key | PVMDAMXGKHIMSQ-YDHLFZDLSA-N |
| Synonym | B-PABA;N-(+)-BIOTINYL-4-AMINOBENZOIC ACID;Benzoic acid, 4-((5-(hexahydro-2-oxo-1H-thieno(3,4-D)imidazol-4-yl)-1-oxopentyl)amino)-, ion(1-)-;Biot-pab;N-(+)-Biotinyl-4-AMinobnzoic Acid;4-(5-((4S)-2-oxohexahydro-1H-thieno[3,4-d]iMidazol-4-yl)pentanaMido)benzoic acid;Benzoic acid, 4-[[5-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-1-oxopentyl]amino]-;4-[5-(2-oxohexahydrothieno[3,4-d]imidazol-6-yl)pentanoylamino]benzoic acid |
| CAS No. | 6929-40-4 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACFMAL870 Molecular Building Block Synthetic Route
Sodium 4-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)benzoate
6-(5-((3AS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)-2-naphthoic acid
N-(4-Hydroxyphenyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide