SGLT inhibitor-1

CAT: 0931-T12893-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T12893-01Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2247314-23-2

Target

SGLT

Related Pathways

GPCR/G Protein

Bioactivity

SGLT inhibitor-1 is a potentsodium glucose co-transporter proteins (SGLTs) dual inhibitor (hSGLT1 and hSGLT2 with IC50s of 43 nM and 9 nM, respectively) .

Smiles

O(C)C=1C(=CC(CC=2C=C3C(=CC2)OCCO3)=C4C1CCO4)[C@@H]5O[C@H](CO)[C@@H](F)[C@H](O)[C@H]5O

Molecular Formula

C24H27FO8

Molecular Weight

462.46

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

SGLT inhibitor-1

CAS Number	2247314-23-2
PubChem CID	137498470
IUPAC Name	(2S,3R,4R,5S,6R)-2-[7-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-methoxy-2,3-dihydro-1-benzofuran-5-yl]-5-fluoro-6-(hydroxymethyl)oxane-3,4-diol
Molecular Formula	C24H27FO8
Molecular Weight	462.5
XLogP	1.6
Topological Polar Surface Area	107
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	5
Heavy Atom Count	33
Formal Charge	0
Complexity	654

SMILES

COC1=C(C=C(C2=C1CCO2)CC3=CC4=C(C=C3)OCCO4)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)F)O)O

InChI

InChI=1S/C24H27FO8/c1-29-23-14-4-5-32-22(14)13(8-12-2-3-16-17(9-12)31-7-6-30-16)10-15(23)24-21(28)20(27)19(25)18(11-26)33-24/h2-3,9-10,18-21,24,26-28H,4-8,11H2,1H3/t18-,19-,20+,21-,24+/m1/s1

InChIKey

QUHJWCHBJBZVQP-IDYLKPADSA-N

Chemical Structure

2D Structure

CAS: 2247314-23-2

CID: 137498470

Formula: C24H27FO8

MW: 462.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	462.5
XLogP3	1.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	5
Exact Mass	462.16899598
Monoisotopic Mass	462.16899598
Topological Polar Surface Area	107 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	654
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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HY-112807	SGLT inhibitor-1
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SGLT inhibitor-1

Chemical Information

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