(±) -[10]Gingerol

CAT: 0013-GTR19277728-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19277728-01Size:1 mg

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Description

(±) -Gingerol is a natural product that can be used in life science research.

CAS Number

107257-18-1

Smiles

CCCCCCCCC[C@@H] (O) CC (=O) CCC1=CC (OC) =C (O) C=C1

Molecular Formula

C21H34O4

Molecular Weight

350.5

Notes

For research use only.

Chemical Information

5-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one

(S)-[10]-Gingerol is a monomethoxybenzene, a member of phenols and a beta-hydroxy ketone.

CAS Number	107257-18-1
PubChem CID	5275726
IUPAC Name	5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one
Molecular Formula	C21H34O4
Molecular Weight	350.5
XLogP	5.3
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	14
Heavy Atom Count	25
Formal Charge	0
Complexity	345

SMILES

CCCCCCCCCC(CC(=O)CCC1=CC(=C(C=C1)O)OC)O

InChI

InChI=1S/C21H34O4/c1-3-4-5-6-7-8-9-10-18(22)16-19(23)13-11-17-12-14-20(24)21(15-17)25-2/h12,14-15,18,22,24H,3-11,13,16H2,1-2H3

InChIKey

AIULWNKTYPZYAN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 107257-18-1

CID: 5275726

Formula: C21H34O4

MW: 350.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	350.5
XLogP3	5.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	14
Exact Mass	350.24570956
Monoisotopic Mass	350.24570956
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	345
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes