Propargyl β-D-lactoside

CAT: 0862-GC9653-50mgSize: 50 mgDry Ice: NoHazardous: No

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CAT#:0862-GC9653-50mgSize:50 mg

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CAS Number

857642-16-1

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Chemical Information

2-Propynyl beta-D-lactopyranoside

CAS Number	857642-16-1
PubChem CID	74820743
IUPAC Name	2-[4,5-dihydroxy-2-(hydroxymethyl)-6-prop-2-ynoxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Formula	C15H24O11
Molecular Weight	380.34
XLogP	-4.1
Topological Polar Surface Area	179
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	6
Heavy Atom Count	26
Formal Charge	0
Complexity	493

SMILES

C#CCOC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O

InChI

InChI=1S/C15H24O11/c1-2-3-23-14-12(22)10(20)13(7(5-17)25-14)26-15-11(21)9(19)8(18)6(4-16)24-15/h1,6-22H,3-5H2

InChIKey

PVLGGYRASUDQSJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 857642-16-1

CID: 74820743

Formula: C15H24O11

MW: 380.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	380.34
XLogP3	-4.1
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	6
Exact Mass	380.13186158
Monoisotopic Mass	380.13186158
Topological Polar Surface Area	179 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	493
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	10
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
C52014-25MG	Propargyl β-D-lactoside
MP31404-01	Propargyl a-D-glucopyranoside
MP09655-01	Propargyl a-D-galactopyranoside
HY-W039896-01	Propargyl a-D-mannopyranoside
BICL2509-01	Propargyl ß-D-maltoside
FP152933-01	Propargyl β-D-glucopyranoside
sc-212591	Propargyl α-D-Galactopyranoside
BICL2511-01	Propargyl ß-D-xylopyranoside
MP15279-01	Propargyl b-D-galactopyranoside
DUD40973-01	Propargyl-PEG2-β-D-glucose