Products for Research Use Only
RegisterLogin

Glucoallosamidin A

CAT: 0013-GTR19256099-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19256099-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Glucoallosamidin A is a glycoside antibiotic that inhibits chitinase activity. It effectively suppresses the chitinase enzyme in Candida albicans [ATCC 10231], exhibiting an IC50 of 3.4 μg/mL.
CAS Number
136236-41-4
Field of Research
Infectious Disease & Virology
Smiles
C (O) [C@H]1[C@]2 ([C@@] ([C@@H] (O) [C@@H]1O[C@H]3[C@H] (NC (C) =O) [C@@H] (O) [C@H] (O[C@H]4[C@H] (NC (C) =O) [C@H] (O) [C@H] (O) [C@@H] (COC) O4) [C@@H] (CO) O3) (N=C (N (C) C) O2) [H]) [H]
Molecular Formula
C26H44N4O14
Molecular Weight
636.646
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Glucoallosamidin A

Glucoallosamidin A is a N-acyl-hexosamine.

CAS Number136236-41-4
PubChem CID139589250
IUPAC NameN-[(2S,3R,4R,5S,6R)-2-[(2S,3S,4R,5R,6R)-6-[[(3aS,4S,5S,6R,6aR)-2-(dimethylamino)-4-hydroxy-6-(hydroxymethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-5-yl]oxy]-5-acetamido-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(methoxymethyl)oxan-3-yl]acetamide
Molecular FormulaC26H44N4O14
Molecular Weight636.6
XLogP-5.7
Topological Polar Surface Area251
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count15
Rotatable Bond Count11
Heavy Atom Count44
Formal Charge0
Complexity1040
SMILES
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@@H](O[C@H]([C@@H]([C@H]2O)NC(=O)C)O[C@H]3[C@@H]([C@@H]4[C@H]([C@@H]3O)N=C(O4)N(C)C)CO)CO)COC)O)O
InChI
InChI=1S/C26H44N4O14/c1-9(33)27-15-18(36)17(35)13(8-39-5)41-24(15)43-23-12(7-32)40-25(16(20(23)38)28-10(2)34)42-22-11(6-31)21-14(19(22)37)29-26(44-21)30(3)4/h11-25,31-32,35-38H,6-8H2,1-5H3,(H,27,33)(H,28,34)/t11-,12+,13-,14+,15-,16-,17-,18-,19+,20-,21-,22+,23-,24+,25+/m1/s1
InChIKey
ZUMIOCAXBMIRDA-GDHIJPQJSA-N
Chemical Structure
2D Structure
2D structure of Glucoallosamidin A
CAS: 136236-41-4
CID: 139589250
Formula: C26H44N4O14
MW: 636.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight636.6
XLogP3-5.7
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count15
Rotatable Bond Count11
Exact Mass636.28540209
Monoisotopic Mass636.28540209
Topological Polar Surface Area251 Ų
Heavy Atom Count44
Formal Charge0
Complexity1040
Isotope Atom Count0
Defined Atom Stereocenter Count15
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N14583Glucoallosamidin A
TN10337-01Glucoallosamidin B

Popular Products