Glucose Impurity 4

CAT: 1596-AR-G02387-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-G02387-02Size:25 Units

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CAS Number

175845-69-9

Molecular Formula

C14H25NO12

Molecular Weight

399.35

API Name

Glucose

Chemical Information

Glucose Impurity 40

CAS Number	175845-69-9
PubChem CID	176484573
IUPAC Name	2-[bis[[(2R,3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]amino]acetic acid
Molecular Formula	C14H25NO12
Molecular Weight	399.35
XLogP	-8.3
Topological Polar Surface Area	221
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	6
Heavy Atom Count	27
Formal Charge	0
Complexity	498

SMILES

C1[C@H]([C@H]([C@@H]([C@](O1)(CN(CC(=O)O)C[C@@]2([C@H]([C@@H]([C@@H](CO2)O)O)O)O)O)O)O)O

InChI

InChI=1S/C14H25NO12/c16-6-2-26-13(24,11(22)9(6)20)4-15(1-8(18)19)5-14(25)12(23)10(21)7(17)3-27-14/h6-7,9-12,16-17,20-25H,1-5H2,(H,18,19)/t6-,7-,9-,10-,11+,12+,13-,14-/m1/s1

InChIKey

PWBSVUZOLJLXOI-GUKSMMDYSA-N

Chemical Structure

2D Structure

CAS: 175845-69-9

CID: 176484573

Formula: C14H25NO12

MW: 399.35

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	399.35
XLogP3	-8.3
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	6
Exact Mass	399.13767523
Monoisotopic Mass	399.13767523
Topological Polar Surface Area	221 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	498
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
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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RG-A263071-01	Glucose Impurity 7
RG-A080306-01	Glucose Impurity 6
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Glucose Impurity 4

Chemical Information

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