Vanillic acid glucoside

CAT: 0804-HY-114760-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-114760-01Size:1 mg

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Description

Vanillic acid glucoside (Vanillic acid 4-β-D-glucoside), a hydrolyzable tannin, is isolated from the fruits of C. annuum as well as the leaves of various additional plants. Vanillic acid glucoside can be phytotoxic against different species.

CAS Number

32142-31-7

Product Name Alternative

Vanillic acid 4-β-D-glucoside

UNSPSC

12352005

Target

Others

Type

Natural Products

Related Pathways

Others

Field of Research

Others

Assay Protocol

https://www.medchemexpress.com/vanillic-acid-glucoside.html

Purity

98.18

Solubility

DMSO : 50 mg/mL (ultrasonic)

Smiles

O=C(O)C1=CC=C(O[C@H]2[C@@H]([C@H]([C@@H]([C@@H](CO)O2)O)O)O)C(OC)=C1

Molecular Formula

C14H18O9

Molecular Weight

330.29

Shipping Conditions

Blue Ice

Storage Conditions

-20°C (Powder, sealed storage, away from moisture)

Scientific Category

Natural Products

Clinical Information

No Development Reported

Chemical Information

Vanillic acid glucoside

Vanillic acid glucoside is a tannin.

CAS Number	32142-31-7
PubChem CID	14132336
IUPAC Name	3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoic acid
Molecular Formula	C14H18O9
Molecular Weight	330.29
XLogP	-1.5
Topological Polar Surface Area	146
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	5
Heavy Atom Count	23
Formal Charge	0
Complexity	404

SMILES

COC1=C(C=CC(=C1)C(=O)O)OC2C(C(C(C(O2)CO)O)O)O

InChI

InChI=1S/C14H18O9/c1-21-8-4-6(13(19)20)2-3-7(8)22-14-12(18)11(17)10(16)9(5-15)23-14/h2-4,9-12,14-18H,5H2,1H3,(H,19,20)

InChIKey

JYFOSWJYZIVJPO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 32142-31-7

CID: 14132336

Formula: C14H18O9

MW: 330.29

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	330.29
XLogP3	-1.5
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	5
Exact Mass	330.09508215
Monoisotopic Mass	330.09508215
Topological Polar Surface Area	146 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	404
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	5
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
583121	Vanillic acid glucoside
sc-506120	Vanillic acid 4-β-D-glucoside
MV173458-01	Vanillic acid 4-beta-D-glucoside
AB1695	Vanillic acid

Vanillic acid glucoside

Chemical Information

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