CAS
94108-01-7 Purity
96%
94108-01-7 Purity
96%
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N-(1-Oxobutyl)-L-cystine
CAS
94108-05-1
Catalog Number
ACM94108051
Category
Other Products
Molecular Weight
310.390320 [g/mol]
Molecular Formula
C10H18N2O5S2
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Specification
Synonyms
N-(1-Oxobutyl)-L-cystine, EINECS 302-342-9, 94108-05-1
IUPAC Name
(2R)-2-amino-3-[[(2R)-2-(butanoylamino)-3-hydroxy-3-oxopropyl]disulfanyl]propanoic acid
Canonical SMILES
CCCC(=O)NC(CSSCC(C(=O)O)N)C(=O)O
InChI Key
DZLKMQVMKBHIIE-BQBZGAKWSA-N
EC Number
302-342-9
H-Bond Acceptor
6
H-Bond Donor
4
What is the molecular formula of N-(1-Oxobutyl)-L-cystine according to the reference?
The molecular formula of N-(1-Oxobutyl)-L-cystine is C10H18N2O5S2.
What is the molecular weight of N-(1-Oxobutyl)-L-cystine?
The molecular weight of N-(1-Oxobutyl)-L-cystine is 310.4 g/mol.
What is the IUPAC Name of N-(1-Oxobutyl)-L-cystine?
The IUPAC Name of N-(1-Oxobutyl)-L-cystine is (2R)-2-amino-3-[[(2R)-2-(butanoylamino)-2-carboxyethyl]disulfanyl]propanoic acid.
What is the InChIKey of N-(1-Oxobutyl)-L-cystine?
The InChIKey of N-(1-Oxobutyl)-L-cystine is DZLKMQVMKBHIIE-BQBZGAKWSA-N.
What is the Canonical SMILES of N-(1-Oxobutyl)-L-cystine?
The Canonical SMILES of N-(1-Oxobutyl)-L-cystine is CCCC(=O)NC(CSSCC(C(=O)O)N)C(=O)O.
How many hydrogen bond donor counts are present in N-(1-Oxobutyl)-L-cystine?
There are 4 hydrogen bond donor counts in N-(1-Oxobutyl)-L-cystine.
What is the exact mass of N-(1-Oxobutyl)-L-cystine?
The exact mass of N-(1-Oxobutyl)-L-cystine is 310.06571403 g/mol.
What is the topological polar surface area of N-(1-Oxobutyl)-L-cystine?
The topological polar surface area of N-(1-Oxobutyl)-L-cystine is 180 Å2.
How many defined atom stereocenter counts are present in N-(1-Oxobutyl)-L-cystine?
There are 2 defined atom stereocenter counts in N-(1-Oxobutyl)-L-cystine.
Is the compound canonicalized for N-(1-Oxobutyl)-L-cystine?
Yes, the compound is canonicalized for N-(1-Oxobutyl)-L-cystine.
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