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(S)-Amino Carnitine

CAT: 0572-TRC-A603405-1MGSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-A603405-1MGSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
125377-87-9
Synonyms
1-Propanaminium, 2-amino-3-carboxy-N,N,N-trimethyl-, inner salt, (2S)-; 1-Propanaminium, 2-amino-3-carboxy-N,N,N-trimethyl-, inner salt, (S)-; (S)-Emeriamine; (S)-Amino Carnitine
Hazard Statement
Causes skin irritation.
Smiles
C[N+](C)(C)C[C@@H](N)CC(=O)[O-]
Molecular Formula
C7 H16 N2 O2
Molecular Weight
160.21
InChI
InChI=1S/C7H16N2O2/c1-9(2,3)5-6(8)4-7(10)11/h6H,4-5,8H2,1-3H3/t6-/m0/s1
Additionnal Information
IUPAC name: (3S)-3-amino-4-(trimethylazaniumyl)butanoate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

(S)-Amino Carnitine
CAS Number125377-87-9
PubChem CID10197827
IUPAC Name(3S)-3-amino-4-(trimethylazaniumyl)butanoate
Molecular FormulaC7H16N2O2
Molecular Weight160.21
XLogP-2.7
Topological Polar Surface Area66.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity134
SMILES
C[N+](C)(C)C[C@H](CC(=O)[O-])N
InChI
InChI=1S/C7H16N2O2/c1-9(2,3)5-6(8)4-7(10)11/h6H,4-5,8H2,1-3H3/t6-/m0/s1
InChIKey
DAWBGYHPBBDHMQ-LURJTMIESA-N
Chemical Structure
2D Structure
2D structure of (S)-Amino Carnitine
CAS: 125377-87-9
CID: 10197827
Formula: C7H16N2O2
MW: 160.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight160.21
XLogP3-2.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass160.121177757
Monoisotopic Mass160.121177757
Topological Polar Surface Area66.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity134
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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002060S-Amino Carnitine
sc-391837(S) -Amino Carnitine
MBS6018447-01(S)-Amino Carnitine
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C1385-29JS-Carnitine Mesylate, Meslate Salt
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