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122535-63-1

122535-63-1 structural image
Product Name: citreamicin alpha
Formula: C36H31NO12
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COMPUTED DESCRIPTORS

Molecular Weight 669.6 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 7
Exact Mass 669.18462542 g/mol
Monoisotopic Mass 669.18462542 g/mol
Topological Polar Surface Area 172 Ų
Heavy Atom Count 49
Formal Charge 0
Complexity 1520
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(16-hydroxy-11,12-dimethoxy-1,1-dimethyl-2,8,14,15,17-pentaoxo-1,2,8,14,15,17-hexahydrochromeno[2',3':6,7]naphtho[2,1-g]oxazolo[3,2-b]isoquinolin-3a(4H)-yl)methyl 3-methylbutanoate is a natural product found in Micromonospora citrea with data available.