Basic information
- CAS
264130-61-2- Standard SMILES
CSCC[C@H](NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)C(C)C- InChIKey
VXFBVWIYIIPMCO-OLDNPOFQSA-N- Molecular formula
- C34H60N10O8S2
- Average molar mass
- 801 g/mol
- Monoisotopic mass
- 800.40370126
Names & identifiers
- Preferred name
- L-Proline, L-methionyl-L-methionyl-L-arginyl-L-valyl-L-alanyl-L-prolyl-
- IUPAC
- (2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Names & synonyms
264130-61-2L-Proline, L-methionyl-L-methionyl-L-arginyl-L-valyl-L-alanyl-L-prolyl-DTXSID60432469L-Methionyl-L-methionyl-N~5~-(diaminomethylidene)-L-ornithyl-L-valyl-L-alanyl-L-prolyl-L-proline
Database identifiers
- CAS
264130-61-2- PubChem CID
- 9897232
- DTXSID
DTXSID60432469
Properties
Computed structural properties
- XLogP
- -2.9
- Topological polar surface area
- 335 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 22
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 1,350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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