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13270-60-5

13270-60-5 structural image
Product Name: PETUNIDIN CHLORIDE
Formula: C16H13ClO7
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid

COMPUTED DESCRIPTORS

Molecular Weight 317.27 g/mol
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 317.06612775 g/mol
Monoisotopic Mass 317.06612775 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 23
Formal Charge 1
Complexity 406
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

PRODUCT INTRODUCTION

description

Petunidin is an anthocyanidin cation that is flavylium bearing five hydroxy substituents at positions 3, 3', 4', 5 and 7 as well as a methoxy substituent at position 5'. It has a role as a plant metabolite. It is a conjugate acid of a petunidin(1-).