Basic information
- CAS
410078-24-9- Standard SMILES
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)O- InChIKey
HVZWMRRLJAABGB-FLMSMKGQSA-N- Molecular formula
- C39H78N16O9
- Average molar mass
- 915.1 g/mol
- Monoisotopic mass
- 914.61376813
Names & identifiers
- Preferred name
- L-Lysyl-L-seryl-N~5~-(diaminomethylidene)-L-ornithyl-L-lysyl-N~5~-(diaminomethylidene)-L-ornithyl-L-lysyl-L-leucine
- IUPAC
- (2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-4-methylpentanoic acid
Names & synonyms
410078-24-9DTXSID10785659L-Lysyl-L-seryl-N~5~-(diaminomethylidene)-L-ornithyl-L-lysyl-N~5~-(diaminomethylidene)-L-ornithyl-L-lysyl-L-leucine
Database identifiers
- CAS
410078-24-9- PubChem CID
- 71362017
- DTXSID
DTXSID10785659
Properties
Computed structural properties
- XLogP
- -7.8
- Topological polar surface area
- 465 Ų
- Hydrogen bond donors
- 16
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 36
- Heavy atoms
- 64
- Formal charge
- 0
- Complexity
- 1,490
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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