Lycomarasmine
Basic information
- CAS
7611-43-0- Standard SMILES
NC(=O)CNC(CN[C@@H](CC(=O)O)C(=O)O)C(=O)O- InChIKey
YRSDOJQPYZOCMY-ROLXFIACSA-N- Molecular formula
- C9H15N3O7
- Average molar mass
- 277.23 g/mol
- Monoisotopic mass
- 277.09099983
Overview
Lycomarasmine B is an amino acid amide.
Names & identifiers
- Preferred name
- Lycomarasmine
- IUPAC
- (2S)-2-[[2-[(2-amino-2-oxoethyl)amino]-2-carboxyethyl]amino]butanedioic acid
Names & synonyms
LycomarasmineLycomarasmine B7611-43-0LycomarasminUNII-2GPV4O05ZY2GPV4O05ZYWELKSTOFFL-Aspartic acid, N-(2-((2-amino-2-oxoethyl)amino)-2-carboxyethyl)-LYCOMARASMINE [MI](2S)-2-((2-((2-AMINO-2-OXOETHYL)AMINO)-3-HYDROXY-3-OXOPROPYL)AMINO)BUTANEDIOIC ACID(2S)-2-[[2-[(2-amino-2-oxo-ethyl)amino]-2-carboxy-ethyl]amino]butanedioic acid(2S)-2-((2-((2-amino-2-oxo-ethyl)amino)-2-carboxy-ethyl)amino)butanedioic acid
Show more names
RefChem:154609(2S)-2-[[2-[(2-amino-2-oxoethyl)amino]-2-carboxyethyl]amino]butanedioic acidC08496AC1L9BC7CHEBI:6594SCHEMBL3188628DTXSID90997470Q27107259
Database identifiers
- CAS
7611-43-0- PubChem CID
- 441571
- DTXSID
DTXSID90997470- ChEBI
CHEBI:6594- UNII
- 2GPV4O05ZY
- Nikkaji
- J15.391E
Properties
Computed structural properties
- XLogP
- -7.5
- Topological polar surface area
- 179 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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