N~5~-(Diaminomethylidene)-L-ornithyl-L-methionyl-L-seryl-L-asparaginyl-L-leucyl-L-alanyl-L-serine
Basic information
- CAS
263365-34-0- Standard SMILES
CSCC[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O- InChIKey
JFZGVCSUNVJZIG-BPSSIEEOSA-N- Molecular formula
- C30H55N11O11S
- Average molar mass
- 777.9 g/mol
- Monoisotopic mass
- 777.38032279
Names & identifiers
- Preferred name
- N~5~-(Diaminomethylidene)-L-ornithyl-L-methionyl-L-seryl-L-asparaginyl-L-leucyl-L-alanyl-L-serine
- IUPAC
- (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxypropanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-3-hydroxypropanoic acid
Names & synonyms
263365-34-0SCHEMBL29593987DTXSID70703854N~5~-(Diaminomethylidene)-L-ornithyl-L-methionyl-L-seryl-L-asparaginyl-L-leucyl-L-alanyl-L-serine
Database identifiers
- CAS
263365-34-0- PubChem CID
- 53477073
- DTXSID
DTXSID70703854
Properties
Computed structural properties
- XLogP
- -7.4
- Topological polar surface area
- 411 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 26
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,300
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Related reactions
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Compound notes
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