BMT

4-METHYL-4-[(E)-2-BUTENYL]-4,N-METHYL-THREONINE

Created:	1999-07-08
Last modified:	2024-09-27

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49 entries where BMT is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	3
Bond Count	32
Aromatic Bond Count	0

2D diagram of BMT

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Chemical Component Summary
Name	4-METHYL-4-[(E)-2-BUTENYL]-4,N-METHYL-THREONINE
Systematic Name (OpenEye OEToolkits)	(E,2S,3R,4R)-4-methyl-2-(methylamino)-3-oxidanyl-oct-6-enoic acid
Formula	C₁₀ H₁₉ N O₃
Molecular Weight	201.263
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(NC)C(O)C(C/C=C/C)C
SMILES	CACTVS	3.370	CN[CH]([CH](O)[CH](C)CC=CC)C(O)=O
SMILES	OpenEye OEToolkits	1.7.2	CC=CCC(C)C(C(C(=O)O)NC)O
Canonical SMILES	CACTVS	3.370	CN[C@@H]([C@H](O)[C@H](C)C\C=C\C)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.2	C/C=C/C[C@@H](C)[C@H]([C@@H](C(=O)O)NC)O
InChI	InChI	1.03	InChI=1S/C10H19NO3/c1-4-5-6-7(2)9(12)8(11-3)10(13)14/h4-5,7-9,11-12H,6H2,1-3H3,(H,13,14)/b5-4+/t7-,8+,9-/m1/s1
InChIKey	InChI	1.03	AHQFCPOIMVMDEZ-UNISNWAASA-N

Related Resource References

Resource Name	Reference
PubChem	11769539
ChEMBL	CHEMBL1231401

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