CAS
94386-64-8 Purity
96%
94386-64-8 Purity
96%
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N-Acetylcilastatin
CAS
94388-32-6
Catalog Number
ACM94388326
Category
Other Products
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- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
What is the PubChem CID of N-Acetylcilastatin?
PubChem CID 6438579
What is the molecular formula of N-Acetylcilastatin?
The molecular formula is C18H28N2O6S.
What are the synonyms for N-Acetylcilastatin?
Some synonyms for N-Acetylcilastatin include 94388-32-6, (Z)-7-[(2S)-2-acetamido-2-carboxyethyl]sulfanyl-2-[[(1S)-2,2-dimethylcyclopropanecarbonyl]amino]hept-2-enoic acid.
What is the molecular weight of N-Acetylcilastatin?
The molecular weight is 400.5 g/mol.
What is the IUPAC name of N-Acetylcilastatin?
The IUPAC name is (Z)-7-[(2S)-2-acetamido-2-carboxyethyl]sulfanyl-2-[[(1S)-2,2-dimethylcyclopropanecarbonyl]amino]hept-2-enoic acid.
What is the InChI of N-Acetylcilastatin?
The InChI is InChI=1S/C18H28N2O6S/c1-11(21)19-14(17(25)26)10-27-8-6-4-5-7-13(16(23)24)20-15(22)12-9-18(12,2)3/h7,12,14H,4-6,8-10H2,1-3H3,(H,19,21)(H,20,22)(H,23,24)(H,25,26)/b13-7-/t12-,14-/m1/s1.
What is the InChIKey of N-Acetylcilastatin?
The InChIKey is SEQPPJZLZIXXRN-FZKSUDTASA-N.
What is the canonical SMILES of N-Acetylcilastatin?
The canonical SMILES is CC(=O)NC(CSCCCCC=C(C(=O)O)NC(=O)C1CC1(C)C)C(=O)O.
What is the XLogP3-AA value of N-Acetylcilastatin?
The XLogP3-AA value is 1.5.
What is the hydrogen bond donor count of N-Acetylcilastatin?
The hydrogen bond donor count is 4.
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