Glucopsycosine

CAT: 0127-BI3460-01Size: 1 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-BI3460-01Size:1 mg

Selected

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

Quick Request Actions

CAS Number

52050-17-6

Synonyms

Glucosyl-C18-sphingosine, (3R,4S,5S,6R) -2-{[ (4E) -2-amino-3-hydroxyoctadec-4-en-1-yl]oxy}-6- (hydroxymethyl) oxane-3,4,5-triol

MDL Number

MFCD00079314

Smiles

CCCCCCCCCCCCC\C=C\C(O)C(N)COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

Storage Conditions

Store at -20°C

Chemical Information

Glucosyl sphingosine

Beta-D-glucosylsphingosine is D-Glucosylsphingosine in which the anomeric configuration of the glucosyl moiety is beta. It is a beta-D-glucoside and a D-glucosylsphingosine. It is a conjugate base of a beta-D-glucosylsphingosine(1+).

CAS Number	52050-17-6
PubChem CID	5280570
IUPAC Name	(2R,3R,4S,5S,6R)-2-[(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Formula	C24H47NO7
Molecular Weight	461.6
XLogP	3.7
Topological Polar Surface Area	146
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	18
Heavy Atom Count	32
Formal Charge	0
Complexity	479

SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)N)O

InChI

InChI=1S/C24H47NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(27)18(25)17-31-24-23(30)22(29)21(28)20(16-26)32-24/h14-15,18-24,26-30H,2-13,16-17,25H2,1H3/b15-14+/t18-,19+,20+,21+,22-,23+,24+/m0/s1

InChIKey

HHJTWTPUPVQKNA-JIAPQYILSA-N

Chemical Structure

2D Structure

CAS: 52050-17-6

CID: 5280570

Formula: C24H47NO7

MW: 461.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	461.6
XLogP3	3.7
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	18
Exact Mass	461.33525284
Monoisotopic Mass	461.33525284
Topological Polar Surface Area	146 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	479
Isotope Atom Count	0
Defined Atom Stereocenter Count	7
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Glucopsycosine

Chemical Information

Popular Products