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DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE

CAS
94825-17-9
Catalog Number
ACM94825179
Category
Other Products
Molecular Weight
466.527960 [g/mol]
Molecular Formula
C22H34N4O7

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Specification

Synonyms
D-Ala-Gly-Phe-D-Leu, [des-Tyr1, D-Ala2, D-Leu5]-Enkephalin acetate salt, 94825-17-9
IUPAC Name
acetic acid;(2R)-2-[[(2S)-2-[[2-[[(2R)-2-aminopropanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
Canonical SMILES
CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N.CC(=O)O
InChI Key
POCSHNDUXQGTFY-YFBGFLEQSA-N
Exact Mass
466.24300
H-Bond Acceptor
8
H-Bond Donor
6
What is the molecular formula of DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

The molecular formula is C22H34N4O7.

What is the molecular weight of DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

The molecular weight is 466.5 g/mol.

What are some synonyms for DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

Some synonyms include 94825-17-9, DTXSID90745610, and [des-Tyr1, D-Ala2, D-Leu5]-Enkephalin acetate salt.

What is the IUPAC name of DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

The IUPAC name is acetic acid;(2R)-2-[[(2S)-2-[[2-[[(2R)-2-aminopropanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid.

What is the InChIKey of DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

The InChIKey is POCSHNDUXQGTFY-YFBGFLEQSA-N.

What is the Canonical SMILES of DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

The Canonical SMILES is CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C(C)N.CC(=O)O.

How many hydrogen bond donor counts are there in DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

There are 6 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

There are 8 hydrogen bond acceptor counts.

What is the topological polar surface area of DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE?

The topological polar surface area is 188 Å2.

Is DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE a canonicalized compound?

Yes, DES-TYR1,(D-ALA2, D-LEU5)-ENKEPHALIN*ACE TATE is a canonicalized compound.

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