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Luseogliflozin 25mg

CAT: 0628-A13476-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0628-A13476-25Size:25 mg
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CAS Number
898537-18-3

Chemical Information

Luseogliflozin

Luseogliflozin is a diarylmethane.

CAS Number898537-18-3
PubChem CID11988953
IUPAC Name(2S,3R,4R,5S,6R)-2-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-6-(hydroxymethyl)thiane-3,4,5-triol
Molecular FormulaC23H30O6S
Molecular Weight434.5
XLogP2.9
Topological Polar Surface Area125
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count30
Formal Charge0
Complexity514
SMILES
CCOC1=CC=C(C=C1)CC2=CC(=C(C=C2C)OC)[C@H]3[C@@H]([C@H]([C@@H]([C@H](S3)CO)O)O)O
InChI
InChI=1S/C23H30O6S/c1-4-29-16-7-5-14(6-8-16)10-15-11-17(18(28-3)9-13(15)2)23-22(27)21(26)20(25)19(12-24)30-23/h5-9,11,19-27H,4,10,12H2,1-3H3/t19-,20-,21+,22-,23+/m1/s1
InChIKey
WHSOLWOTCHFFBK-ZQGJOIPISA-N
Chemical Structure
2D Structure
2D structure of Luseogliflozin
CAS: 898537-18-3
CID: 11988953
Formula: C23H30O6S
MW: 434.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight434.5
XLogP32.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass434.17630985
Monoisotopic Mass434.17630985
Topological Polar Surface Area125 Ų
Heavy Atom Count30
Formal Charge0
Complexity514
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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