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Lauroylmethionine

CAT: 0931-T32600-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T32600-01Size:25 mg
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CAS Number
35440-74-5
Target
Others
Related Pathways
Others
Bioactivity
Lauroylmethionine is a lysine salt of the product formed by the condensation of lauroyl fatty acid chloride with methionine.
Smiles
[C@H](NC(CCCCCCCCCCC)=O)(CCSC)C(O)=O
Molecular Formula
C17H33NO3S
Molecular Weight
331.51
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Lauroylmethionine
CAS Number35440-74-5
PubChem CID486206
IUPAC Name(2S)-2-(dodecanoylamino)-4-methylsulfanylbutanoic acid
Molecular FormulaC17H33NO3S
Molecular Weight331.5
XLogP5.3
Topological Polar Surface Area91.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count15
Heavy Atom Count22
Formal Charge0
Complexity298
SMILES
CCCCCCCCCCCC(=O)N[C@@H](CCSC)C(=O)O
InChI
InChI=1S/C17H33NO3S/c1-3-4-5-6-7-8-9-10-11-12-16(19)18-15(17(20)21)13-14-22-2/h15H,3-14H2,1-2H3,(H,18,19)(H,20,21)/t15-/m0/s1
InChIKey
PFSGUIFKRGNSHV-HNNXBMFYSA-N
Chemical Structure
2D Structure
2D structure of Lauroylmethionine
CAS: 35440-74-5
CID: 486206
Formula: C17H33NO3S
MW: 331.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight331.5
XLogP35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count15
Exact Mass331.21811509
Monoisotopic Mass331.21811509
Topological Polar Surface Area91.7 Ų
Heavy Atom Count22
Formal Charge0
Complexity298
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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