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N-Formyl-L-valylglycyl-L-seryl-L-glutamic acid

HCID 53471644
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Basic information

CAS
75680-41-0
Standard SMILES
CC(C)[C@H](NC=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIKey
UQNZXXOXXUETEJ-KWBADKCTSA-N
Molecular formula
C16H26N4O9
Average molar mass
418.4 g/mol
Monoisotopic mass
418.16997842

Names & identifiers

Preferred name
N-Formyl-L-valylglycyl-L-seryl-L-glutamic acid
IUPAC
(2S)-2-[[(2S)-2-[[2-[[(2S)-2-formamido-3-methylbutanoyl]amino]acetyl]amino]-3-hydroxypropanoyl]amino]pentanedioic acid

Names & synonyms

75680-41-0DTXSID80703704N-FORMYL-L-VALYLGLYCYL-L-SERYL-L-GLUTAMIC ACID

Database identifiers

CAS
75680-41-0
PubChem CID
53471644
DTXSID
DTXSID80703704

Properties

Computed structural properties

XLogP
-2.2
Topological polar surface area
211 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
9
Rotatable bonds
13
Heavy atoms
29
Formal charge
0
Complexity
624

Related reactions

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Compound notes

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