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Structure

L-Lysine s-(carboxymethyl)-l-cysteine

CAS
49673-81-6
Catalog Number
ACM49673816
Category
Other Products
Molecular Weight
325.38
Molecular Formula
C11H23N3O6S

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Specification

Synonyms
S-Carboxymethyl-L-cysteine lysinate
IUPAC Name
(2R)-2-amino-3-(carboxymethylsulfanyl)propanoic acid;(2S)-2,6-diaminohexanoic acid
Canonical SMILES
C(CCN)C[C@@H](C(=O)O)N.C([C@@H](C(=O)O)N)SCC(=O)O
InChI
InChI=1S/C6H14N2O2.C5H9NO4S/c7-4-2-1-3-5(8)6(9)10;6-3(5(9)10)1-11-2-4(7)8/h5H,1-4,7-8H2,(H,9,10);3H,1-2,6H2,(H,7,8)(H,9,10)/t5-;3-/m00/s1
InChI Key
SAGXGPWVLUSDSQ-RVZXSAGBSA-N
Appearance
Solid
What is the molecular formula of L-Lysine S-(carboxymethyl)-L-cysteine?

The molecular formula is C11H21N3O5S.

When was L-Lysine S-(carboxymethyl)-L-cysteine created and last modified?

It was created on 2015-02-16 and last modified on 2023-12-30.

What is the IUPAC name of L-Lysine S-(carboxymethyl)-L-cysteine?

The IUPAC name is (2R)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-methoxycarbonylsulfanylpropanoic acid.

What is the InChI of L-Lysine S-(carboxymethyl)-L-cysteine?

The InChI is InChI=1S/C11H21N3O5S/c1-19-11(18)20-6-8(10(16)17)14-9(15)7(13)4-2-3-5-12/h7-8H,2-6,12-13H2,1H3,(H,14,15)(H,16,17)/t7-,8-/m0/s1.

What is the InChIKey of L-Lysine S-(carboxymethyl)-L-cysteine?

The InChIKey is YFFWSBNJVSEWRX-YUMQZZPRSA-N.

How many hydrogen bond donor counts does L-Lysine S-(carboxymethyl)-L-cysteine have?

It has 4 hydrogen bond donor counts.

What is the exact mass of L-Lysine S-(carboxymethyl)-L-cysteine?

The exact mass is 307.12019195 g/mol.

How many rotatable bond counts does L-Lysine S-(carboxymethyl)-L-cysteine have?

It has 11 rotatable bond counts.

Is L-Lysine S-(carboxymethyl)-L-cysteine canonicalized?

Yes, the compound is canonicalized.

What is the topological polar surface area of L-Lysine S-(carboxymethyl)-L-cysteine?

The topological polar surface area is 170Ų.

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