CMT

O-METHYLCYSTEINE

Created:	2000-01-19
Last modified:	2024-09-27

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3 entries where CMT is covalently linked to polymer or other heterogen groups 19 entries where CMT is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	17
Chiral Atom Count	1
Bond Count	16
Aromatic Bond Count	0

2D diagram of CMT

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Chemical Component Summary
Name	O-METHYLCYSTEINE
Systematic Name (OpenEye OEToolkits)	methyl (2R)-2-amino-3-sulfanyl-propanoate
Formula	C₄ H₉ N O₂ S
Molecular Weight	135.185
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(OC)C(N)CS
SMILES	CACTVS	3.341	COC(=O)[CH](N)CS
SMILES	OpenEye OEToolkits	1.5.0	COC(=O)C(CS)N
Canonical SMILES	CACTVS	3.341	COC(=O)[C@@H](N)CS
Canonical SMILES	OpenEye OEToolkits	1.5.0	COC(=O)[C@H](CS)N
InChI	InChI	1.03	InChI=1S/C4H9NO2S/c1-7-4(6)3(5)2-8/h3,8H,2,5H2,1H3/t3-/m0/s1
InChIKey	InChI	1.03	MCYHPZGUONZRGO-VKHMYHEASA-N

Related Resource References

Resource Name	Reference
PubChem	1550140, 29145
ChEMBL	CHEMBL1231844
ChEBI	CHEBI:41531
CCDC/CSD	VEDCEM

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