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1763-10-6

1763-10-6 structural image
Product Name: PALMITOYL COENZYME A POTASSIUM SALT
Formula: C37H66N7O17P3S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Collision Cross Section 296.2 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]

COMPUTED DESCRIPTORS

Molecular Weight 1005.9 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 9
Hydrogen Bond Acceptor Count 22
Rotatable Bond Count 34
Exact Mass 1005.34487583 g/mol
Monoisotopic Mass 1005.34487583 g/mol
Topological Polar Surface Area 389 Ų
Heavy Atom Count 65
Formal Charge 0
Complexity 1620
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Palmitoyl-CoA is a long-chain fatty acyl-CoA resulting from the formal condensation of the carboxy group of hexadecanoic acid with the thiol group of coenzyme A. It has a role as an Escherichia coli metabolite and a mouse metabolite. It is a long-chain fatty acyl-CoA, a palmitoyl bioconjugate, an 11,12-saturated fatty acyl-CoA and a 3-substituted propionyl-CoA. It is functionally related to a coenzyme A, a hexadecanoic acid and a hexadecanoate. It is a conjugate acid of a palmitoyl-CoA(4-).