L-Isoleucinamide, N-acetyl-L-alanyl-L-alanyl-D-tyrosyl-L-prolyl-

HCID 5479219CAS 133683-34-8
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Basic information

Standard SMILES
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(C)=O)C(N)=O
InChIKey
HEJIKQWSJVRFIV-LDIWCKMVSA-N
Molecular formula
C28H42N6O7
Average molar mass
574.7 g/mol
Monoisotopic mass
574.31149768

Names & identifiers

Preferred name
L-Isoleucinamide, N-acetyl-L-alanyl-L-alanyl-D-tyrosyl-L-prolyl-
IUPAC
(2S)-1-[(2R)-2-[[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]-N-[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide

Names & synonyms

Ac-Ala-Ala-D-Tyr-Pro-Ile-NH2L-Isoleucinamide, N-acetyl-L-alanyl-L-alanyl-D-tyrosyl-L-prolyl-133683-34-8DTXSID40158317N-Acetyl-L-alanyl-L-alanyl-D-tyrosyl-L-prolyl-L-isoleucinamide

Database identifiers

CAS
133683-34-8
PubChem CID
5479219
DTXSID
DTXSID40158317

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
200 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
7
Rotatable bonds
13
Heavy atoms
41

Related reactions

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Linked notes

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