Products for Research Use Only
RegisterLogin

Acetylcarnitine

CAT: 0127-OR1029615-02Size: 5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-OR1029615-02Size:5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
34404-36-9
Synonyms
(2,5-dioxopyrrolidin-1-yl) (2S) -2-[ (2-methylpropan-2-yl) oxycarbonylamino]-6- (phenylmethoxycarbonylamino) hexanoate
Purity
98%
Smiles
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)OCC1=CC=CC=C1)C(=O)ON2C(=O)CCC2=O

Chemical Information

Benzyl (S)-(5-(((1,1-dimethylethoxy)carbonyl)amino)-6-((2,5-dioxo-1-pyrrolidinyl)oxy)-6-oxohexyl)carbamate
CAS Number34404-36-9
PubChem CID118166
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate
Molecular FormulaC23H31N3O8
Molecular Weight477.5
XLogP2.3
Topological Polar Surface Area140
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count14
Heavy Atom Count34
Formal Charge0
Complexity727
SMILES
CC(C)(C)OC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)ON2C(=O)CCC2=O
InChI
InChI=1S/C23H31N3O8/c1-23(2,3)33-22(31)25-17(20(29)34-26-18(27)12-13-19(26)28)11-7-8-14-24-21(30)32-15-16-9-5-4-6-10-16/h4-6,9-10,17H,7-8,11-15H2,1-3H3,(H,24,30)(H,25,31)
InChIKey
YWLICOCXPNQJPC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyl (S)-(5-(((1,1-dimethylethoxy)carbonyl)amino)-6-((2,5-dioxo-1-pyrrolidinyl)oxy)-6-oxohexyl)carbamate
CAS: 34404-36-9
CID: 118166
Formula: C23H31N3O8
MW: 477.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.5
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count14
Exact Mass477.21111496
Monoisotopic Mass477.21111496
Topological Polar Surface Area140 Ų
Heavy Atom Count34
Formal Charge0
Complexity727
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
BUP18707N-Acetylcarnosine

Alternative Products

CatalogName
BA7453-50Acetylcarnitine
254531(±) -Acetylcarnitine chloride
HY-100907-01(±) -Acetylcarnitine (chloride)
TRC-A172003-50MG(±)-Acetylcarnitine Chloride
HY-126358SAcetylcarnitine-d3
HY-126358R-01Acetylcarnitine (Standard)
C3098-25000L-Acetylcarnitine (hydrochloride)
ECP7803Acetylcarnitine ELISA Kit
T29598-01Acetylcarnitine arginyl amide

Popular Products