Clobenoside structure

Clobenoside

(3R,4R,5R)-5-[(1R)-1,2-bis[(4-chlorophenyl)methoxy]ethyl]-2-ethoxy-4-propoxyoxolan-3-ol

CAS: 29899-95-4
Molecular Formula C25H32Cl2O6
Molecular Weight 499.4 g/mol
LogP 4.5
Topological Polar Surface Area 66.4 A2
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 13
Exact Mass 498.1576
Heavy Atoms 33
Complexity 525.0

Chemical Identifiers

CAS Number 29899-95-4
SMILES CCCOC1C(C(OC1C(COCC2=CC=C(C=C2)Cl)OCC3=CC=C(C=C3)Cl)OCC)O
InChIKey UOYOWSGCMGEQHC-MSEXXDKFSA-N

📖 Product Overview

Clobenoside (CAS: 29899-95-4) is a chemical compound with molecular formula C25H32Cl2O6 and molecular weight 499.4 g/mol. Its IUPAC systematic name is (3R,4R,5R)-5-[(1R)-1,2-bis[(4-chlorophenyl)methoxy]ethyl]-2-ethoxy-4-propoxyoxolan-3-ol. LogP 4.5 Topological Polar Surface Area 66.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 13 Exact Mass 498.1576 Heavy Atoms 33 Complexity 525.0 InChI Key: UOYOWSGCMGEQHC-MSEXXDKFSA-N. SMILES: CCCOC1C(C(OC1C(COCC2=CC=C(C=C2)Cl)OCC3=CC=C(C=C3)Cl)OCC)O.

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