Gadoleic acid

CAT: 0804-HY-134895-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-134895-01Size:5 mg

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Description

Gadoleic acid is a kind of biochemical reagent.

CAS Number

29204-02-2

UNSPSC

12352200

Hazard Statement

H302-H315-H319-H335

Target

Biochemical Assay Reagents

Type

Biochemical Assay Reagents

Related Pathways

Others

Assay Protocol

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

Smiles

CCCCCCCCCC/C=C\CCCCCCCC(O)=O

Molecular Formula

C20H38O2

Molecular Weight

310.51

Precautions

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

References & Citations

[1]KITAGAWA, et al. "Preparation and characterization of hetero-bifunctional cross-linking reagents for protein modifications." Chemical and Pharmaceutical Bulletin 29.4 (1981) : 1130-1135.

Shipping Conditions

Room temperature

Scientific Category

Biochemical Assay Reagents

Clinical Information

No Development Reported

Chemical Information

Gadoleic Acid

Gadoleic acid is a 9-icosenoic acid having a cis-double bond at position 9. It has a role as an algal metabolite. It is a conjugate acid of a gadoleate.

CAS Number	29204-02-2
PubChem CID	5282767
IUPAC Name	(Z)-icos-9-enoic acid
Molecular Formula	C20H38O2
Molecular Weight	310.5
XLogP	7.6
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	17
Heavy Atom Count	22
Formal Charge	0
Complexity	258

SMILES

CCCCCCCCCC/C=C\CCCCCCCC(=O)O

InChI

InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h11-12H,2-10,13-19H2,1H3,(H,21,22)/b12-11-

InChIKey

LQJBNNIYVWPHFW-QXMHVHEDSA-N

Chemical Structure

2D Structure

CAS: 29204-02-2

CID: 5282767

Formula: C20H38O2

MW: 310.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	310.5
XLogP3	7.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	17
Exact Mass	310.287180451
Monoisotopic Mass	310.287180451
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	258
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Gadoleic acid

Chemical Information

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