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MGlc-DAG

CAT: 0013-GTR19221360-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19221360-02Size:50 mg
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Description
MGlc-DAG is a glycoglycerolipid that acts as a key biochemical precursor in the development of novel drug delivery systems. Its role is investigated in both in vitro and in vivo research models within pharmaceutical and biochemical studies.
CAS Number
2021179-21-3
Field of Research
Metabolism Research
Smiles
CCCCCCCCCCCCCCCC (=O) O[C@@H] (CO[C@@H]1O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]1O) COC (=O) CCCCCCC\C=C/CCCCCCCC
Molecular Formula
C43H80O10
Molecular Weight
757.09
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 171360955
CAS Number2021179-21-3
PubChem CID171360955
IUPAC Name[(2S)-2-hexadecanoyloxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (Z)-octadec-9-enoate
Molecular FormulaC43H80O10
Molecular Weight757.1
XLogP12.6
Topological Polar Surface Area152
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count38
Heavy Atom Count53
Formal Charge0
Complexity883
SMILES
CCCCCCCCCCCCCCCC(=O)O[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)COC(=O)CCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C43H80O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h17-18,36-37,40-44,47-49H,3-16,19-35H2,1-2H3/b18-17-/t36-,37-,40-,41+,42-,43-/m1/s1
InChIKey
JBZBYHKCRFIXBI-QLIJDHBQSA-N
Chemical Structure
2D Structure
2D structure of CID 171360955
CAS: 2021179-21-3
CID: 171360955
Formula: C43H80O10
MW: 757.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight757.1
XLogP312.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count38
Exact Mass756.57514874
Monoisotopic Mass756.57514874
Topological Polar Surface Area152 Ų
Heavy Atom Count53
Formal Charge0
Complexity883
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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