Heneicosanoic acid

CAT: 0804-HY-121447-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-121447-01Size:250 mg

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Description

Heneicosanoic acid is a long-chain saturated fatty acid which is found in plants and animals[1][2][3].

CAS Number

2363-71-5

UNSPSC

12352211

Hazard Statement

H302, H315, H319, H335

Target

Endogenous Metabolite

Type

Natural Products

Related Pathways

Metabolic Enzyme/Protease

Applications

Metabolism-sugar/lipid metabolism

Field of Research

Metabolic Disease

Assay Protocol

https://www.medchemexpress.com/heneicosanoic-acid.html

Purity

98.0

Solubility

DMSO : 3.33 mg/mL (ultrasonic; warming; heat to 60°C) |Ethanol : 14.29 mg/mL (ultrasonic)

Smiles

CCCCCCCCCCCCCCCCCCCCC(O)=O

Molecular Formula

C21H42O2

Molecular Weight

326.56

Precautions

H302, H315, H319, H335

References & Citations

[1]Kumari R, et, al. Chemical composition of the fatty oils of the seeds of Cleome viscosa accessions. Nat Prod Commun. 2012 Oct;7 (10) :1363-4.|[2]Turgumbayeva AA, et, al. Volatile oil composition of Carthamus Tinctorius L. flowers grown in Kazakhstan. Ann Agric Environ Med. 2018 Mar 14;25 (1) :87-89.|[3]Horvat RJ, et, al. Identification of some new minor acids from chicken skin lipids. Poult Sci. 1978 May;57 (3) :827-8.

Shipping Conditions

Room Temperature

Storage Conditions

-20°C, 3 years; 4°C, 2 years (Powder)

Scientific Category

Natural Products

Clinical Information

No Development Reported

Chemical Information

Heneicosanoic Acid

Henicosanoic acid is a long-chain fatty acid that is henicosane in which one of the methyl groups has been oxidised to give the corresponding carboxylic acid. It is a long-chain fatty acid and a straight-chain saturated fatty acid. It is a conjugate acid of a henicosanoate.

CAS Number	2363-71-5
PubChem CID	16898
IUPAC Name	henicosanoic acid
Molecular Formula	C21H42O2
Molecular Weight	326.6
XLogP	9.1
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	19
Heavy Atom Count	23
Formal Charge	0
Complexity	238

SMILES

CCCCCCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C21H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3,(H,22,23)

InChIKey

CKDDRHZIAZRDBW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2363-71-5

CID: 16898

Formula: C21H42O2

MW: 326.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	326.6
XLogP3	9.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	19
Exact Mass	326.318480578
Monoisotopic Mass	326.318480578
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	238
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
HY-173244	Cis-12-Heneicosenoic acid
HY-166441	Heneicosanoyl chloride
HY-E70276	Heneicosanoyl-CoA
HY-W751899-01	10-Heneicosanone
HY-140112-01	Acid-PEG2-SS-PEG2-acid
HY-140113-01	Acid-PEG3-SS-PEG3-acid
HY-140589	Acid-PEG4-S-PEG4-acid
HY-165752	10-Heneicosanol
HY-134645-01	1-Heneicosanol
HY-W096114-01	Acid-PEG8-S-S-PEG8-acid

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