CUDA

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CAS Number

479413-68-8

Purity

=98%

Smiles

N(C(NCCCCCCCCCCCC(O)=O)=O)C1CCCCC1

Chemical Information

12-((Cyclohexylcarbamoyl)amino)dodecanoic acid

12-[(Cyclohexylcarbamoyl)amino]dodecanoic acid is a medium-chain fatty acid.

CAS Number	479413-68-8
PubChem CID	22978774
IUPAC Name	12-(cyclohexylcarbamoylamino)dodecanoic acid
Molecular Formula	C19H36N2O3
Molecular Weight	340.5
XLogP	5
Topological Polar Surface Area	78.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	13
Heavy Atom Count	24
Formal Charge	0
Complexity	342

SMILES

C1CCC(CC1)NC(=O)NCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C19H36N2O3/c22-18(23)15-11-6-4-2-1-3-5-7-12-16-20-19(24)21-17-13-9-8-10-14-17/h17H,1-16H2,(H,22,23)(H2,20,21,24)

InChIKey

HPTJABJPZMULFH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 479413-68-8

CID: 22978774

Formula: C19H36N2O3

MW: 340.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	340.5
XLogP3	5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	13
Exact Mass	340.27259301
Monoisotopic Mass	340.27259301
Topological Polar Surface Area	78.4 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	342
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

Catalog	Name
T10900-01	CUDA
HY-121538S	CUDA-d11
T206289-01	CUDA disodium
HY-121538A-01	CUDA (disodium)
MBS1165937	Recombinant Dictyostelium discoideum Putative transcriptional regulator cudA (cudA), partial