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D, L-erythro-PDMP

CAT: 0013-GTR19189872Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19189872Size:5 mg
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Description
D, L-erythro-PDMP is a stereoisomer of PDMP that potently inhibits UDP-glucose:ceramide glucosyltransferase (GlcCer synthase) . This activity underlies its observed growth inhibition in rabbit skin fibroblast cultures and its utility as a research tool for studying glycosphingolipid metabolism in cellular models.
CAS Number
109760-77-2
Field of Research
Metabolism Research
Smiles
CCCCCCCCCC (=O) N[C@H] (CN1CCOCC1) [C@@H] (O) c1ccccc1
Molecular Formula
C23H38N2O3
Molecular Weight
390.568
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

D,L-erythro-PDMP
CAS Number109760-77-2
PubChem CID15389176
IUPAC NameN-[(1S,2R)-1-hydroxy-3-morpholin-4-yl-1-phenylpropan-2-yl]decanamide
Molecular FormulaC23H38N2O3
Molecular Weight390.6
XLogP4.2
Topological Polar Surface Area61.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Heavy Atom Count28
Formal Charge0
Complexity407
SMILES
CCCCCCCCCC(=O)N[C@H](CN1CCOCC1)[C@H](C2=CC=CC=C2)O
InChI
InChI=1S/C23H38N2O3/c1-2-3-4-5-6-7-11-14-22(26)24-21(19-25-15-17-28-18-16-25)23(27)20-12-9-8-10-13-20/h8-10,12-13,21,23,27H,2-7,11,14-19H2,1H3,(H,24,26)/t21-,23+/m1/s1
InChIKey
UYNCFCUHRNOSCN-GGAORHGYSA-N
Chemical Structure
2D Structure
2D structure of D,L-erythro-PDMP
CAS: 109760-77-2
CID: 15389176
Formula: C23H38N2O3
MW: 390.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight390.6
XLogP34.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Exact Mass390.28824308
Monoisotopic Mass390.28824308
Topological Polar Surface Area61.8 Ų
Heavy Atom Count28
Formal Charge0
Complexity407
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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