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N-benzyloxycarbonyl-L-tryptophanyl-L-methionyl-L-aspartyl-DL-norvaline amide

HCID 22796407
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCC(NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(N)=O
InChIKey
FFNQRPOICZMCGL-CZEMMQRTSA-N
Molecular formula
C33H42N6O8S
Average molar mass
682.8 g/mol

Names & identifiers

Preferred name
N-benzyloxycarbonyl-L-tryptophanyl-L-methionyl-L-aspartyl-DL-norvaline amide
IUPAC
(3S)-4-[(1-amino-1-oxopentan-2-yl)amino]-3-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-oxobutanoic acid

Names & synonyms

SCHEMBL11699855FFNQRPOICZMCGL-CZEMMQRTSA-NN-benzyloxycarbonyl-L-tryptophanyl-L-methionyl-L-aspartyl-DL-norvaline amide

Database identifiers

PubChem CID
22796407

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
247 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
9
Rotatable bonds
20
Heavy atoms
48
Formal charge
0
Complexity
1,110

Related reactions

2 records
New reaction record
HRID 596808 reaction equation
HRID 596808As productuspto-grants-1977_03
HRID 596809 reaction equation
HRID 596809As reactantuspto-grants-1977_03

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes