Basic information
- CAS
117233-46-2- Standard SMILES
NCCCCCNC(=O)[C@H](CC(N)=O)NC(=O)Cc1c[nH]c2ccccc12- InChIKey
OGOAWQZTZZGJEU-INIZCTEOSA-N- Molecular formula
- C19H27N5O3
- Average molar mass
- 373.4 g/mol
- Monoisotopic mass
- 373.21138974
Overview
Pseudoargiopinin III is an asparagine derivative.
Names & identifiers
- Preferred name
- (2S)-N-(5-aminopentyl)-2-[[2-(1H-indol-3-yl)acetyl]amino]butanediamide
- IUPAC
- (2S)-N-(5-aminopentyl)-2-[[2-(1H-indol-3-yl)acetyl]amino]butanediamide
Names & synonyms
Pseudoargiopinin III117233-46-2(2S)-N-(5-aminopentyl)-2-[[2-(1H-indol-3-yl)acetyl]amino]butanediamideDTXSID50922349CHEBI:179506152886-77-6C20097N~1~-(5-Aminopentyl)-2-{[1-hydroxy-2-(1H-indol-3-yl)ethylidene]amino}butanediimidic acid(2S)-N~1~-(5-Aminopentyl)-2-{[1-hydroxy-2-(1H-indol-3-yl)ethylidene]amino}butanediimidic acid
Database identifiers
- CAS
117233-46-2- PubChem CID
- 189481
- DTXSID
DTXSID50922349- ChEBI
CHEBI:179506- Nikkaji
- J725.784H
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 514
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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