Name: Name:D-Glucopyranose, 2-(acetylamino)-2,4-dideoxy-4-fluoro-, 1,3,6-triacetate
Brand: Angene
SKU: AG000BHF
Rating: 90 (10 reviews)

D-Glucopyranose, 2-(acetylamino)-2,4-dideoxy-4-fluoro-, 1,3,6-triacetate

CAS No.:

116049-57-1

Catalog Number:

AG000BHF

Molecular Formula:

C14H20FNO8

Molecular Weight:

349.3089

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Product Description

Catalog Number:

AG000BHF

Chemical Name:

D-Glucopyranose, 2-(acetylamino)-2,4-dideoxy-4-fluoro-, 1,3,6-triacetate

CAS Number:

116049-57-1

Molecular Formula:

C14H20FNO8

Molecular Weight:

349.3089

MDL Number:

MFCD04116084

IUPAC Name:

[(2R,3S,4R,5R)-5-acetamido-4,6-diacetyloxy-3-fluorooxan-2-yl]methyl acetate

InChI:

InChI=1S/C14H20FNO8/c1-6(17)16-12-13(22-8(3)19)11(15)10(5-21-7(2)18)24-14(12)23-9(4)20/h10-14H,5H2,1-4H3,(H,16,17)/t10-,11-,12-,13+,14?/m1/s1

InChI Key:

AUCRVLBGFFSCPW-LSGALXMHSA-N

SMILES:

CC(=O)OC[C@H]1OC(OC(=O)C)[C@@H]([C@H]([C@@H]1F)OC(=O)C)NC(=O)C

Properties

Complexity:

511

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

349.117g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

349.311g/mol

Monoisotopic Mass:

349.117g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

117A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4

Literature

Title	Journal
Quantitative magnetic resonance image analysis of the cerebellum in macrocephalic and normocephalic children and adults with autism.	Journal of the International Neuropsychological Society : JINS 20080501