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24730-31-2

24730-31-2 structural image
Product Name: SURFACTIN
Formula: C53H93N7O13
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COMPUTED DESCRIPTORS

Molecular Weight 1036.3 g/mol
XLogP3 8.8
Hydrogen Bond Donor Count 9
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 24
Exact Mass 1035.68313605 g/mol
Monoisotopic Mass 1035.68313605 g/mol
Topological Polar Surface Area 305 Ų
Heavy Atom Count 73
Formal Charge 0
Complexity 1800
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
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

Surfactin C is a cyclodepsipeptide that is N-[(3R)-3-hydroxy-13-methyltetradecanoyl]-L-alpha-glutamyl-L-leucyl-D-leucyl-L-valyl-L-alpha-aspartyl-D-leucyl-L-leucine in which the C-terminal carboxy group has been lactonised by condensation with the alcoholic hydroxy group. It has a role as an antibacterial agent, an antifungal agent, an antiviral agent, a surfactant, a metabolite, an antineoplastic agent and a platelet aggregation inhibitor. It is a cyclodepsipeptide, a lipopeptide antibiotic and a macrocyclic lactone.