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561-68-2

561-68-2 structural image
Product Name: 2β,4aα,8α-Trihydroxy-1β,8β-dimethylgibbane-1α,10β-dicarboxylic acid 1,4a-lactone
Formula: C19H26O6
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COMPUTED DESCRIPTORS

Molecular Weight 350.4 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 1
Exact Mass 350.17293854 g/mol
Monoisotopic Mass 350.17293854 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 691
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
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

Gibberellin A2 is a C19-gibberellin, initially identified in Gibberella fujikuroi; it differs from gibberellin A1 in the absence of an OH group at C-7 and the substitution of the methylidene grouping at C-8 by alpha-OH and beta-Me groups (gibbane numberings). It is a C19-gibberellin, a lactone and a gibberellin monocarboxylic acid.