N-t-butoxycarbonyl-L-tryptophanyl-L-methionyl-L-aspartyl-D-alanine amide

HCID 22796331
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Basic information

Standard SMILES
CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C)C(N)=O
InChIKey
MALFZTCXSIGPNI-DVMWJLJYSA-N
Molecular formula
C28H40N6O8S
Average molar mass
620.7 g/mol

Names & identifiers

Preferred name
N-t-butoxycarbonyl-L-tryptophanyl-L-methionyl-L-aspartyl-D-alanine amide
IUPAC
(3S)-4-[[(2R)-1-amino-1-oxopropan-2-yl]amino]-3-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-oxobutanoic acid

Names & synonyms

SCHEMBL10779706MALFZTCXSIGPNI-DVMWJLJYSA-NN-t-butoxycarbonyl-L-tryptophanyl-L-methionyl-L-aspartyl-D-alanine amide

Database identifiers

PubChem CID
22796331

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
247 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
9
Rotatable bonds
17
Heavy atoms
43

Related reactions

4 records
New reaction record

Compound notes

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