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165883-85-2

165883-85-2 structural image
Product Name: D-myo-Inositol, 1-(2R)-2,3-bis(1-oxohexadecyl)oxypropyl hydrogen phosphate 3,4-bis(dihydrogen phosphate)
Formula: C41H81O19P3
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COMPUTED DESCRIPTORS

Molecular Weight 971.0 g/mol
XLogP3 8
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 19
Rotatable Bond Count 42
Exact Mass 970.45849134 g/mol
Monoisotopic Mass 970.45849134 g/mol
Topological Polar Surface Area 303 Ų
Heavy Atom Count 63
Formal Charge 0
Complexity 1350
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
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

1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4-bisphosphate) is a 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate in which the phosphatidyl acyl groups at positions 1 and 2 are both specified as hexadecanoyl (palmitoyl). It is functionally related to a hexadecanoic acid. It is a conjugate acid of a 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4-bisphosphate)(5-).