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85551-10-6

85551-10-6 structural image
Product Name: 8-[(3S,4S)-4α-[(Z)-2-Pentenyl]-5-oxo-1-cyclopentene-3α-yl]octanoic acid
Formula: C18H28O3
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COMPUTED DESCRIPTORS

Molecular Weight 292.4 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 11
Exact Mass 292.20384475 g/mol
Monoisotopic Mass 292.20384475 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 382
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(15Z)-12-oxophyto-10,15-dienoic acid is a carbocyclic fatty acid, an oxo carboxylic acid and an olefinic fatty acid. It is a conjugate acid of a (15Z)-12-oxophyto-10,15-dienoate.