Z-Gln-Thr(tBu)-Ala-Ile-Gly-OMe
Basic information
- Standard SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1)[C@@H](C)OC(C)(C)C)C(=O)NCC(=O)OC- InChIKey
SKMHCZVXSJFBCF-DENJFTDQSA-N- Molecular formula
- C33H52N6O10
- Average molar mass
- 692.8 g/mol
- Monoisotopic mass
- 692.37449188
Names & identifiers
- Preferred name
- Z-Gln-Thr(tBu)-Ala-Ile-Gly-OMe
- IUPAC
- methyl 2-[[(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-[(2-methylpropan-2-yl)oxy]butanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]acetate
Names & synonyms
SKMHCZVXSJFBCF-DENJFTDQSA-NZ-Gln-Thr(tBu)-Ala-Ile-Gly-OMe
Database identifiers
- PubChem CID
- 131709986
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 233 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 22
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 1,140
Related reactions
2 records
Compound notes
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