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Doxorubicin Impurity 6

CAS No.:
69429-21-6
Catalog Number:
AG00FG9X
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00FG9X
Chemical Name:
Doxorubicin Impurity 6
CAS Number:
69429-21-6
MDL Number:
MFCD29919518
IUPAC Name:
(2S)-4-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracene-2-carboxylic acid
InChI:
InChI=1S/C26H27NO11/c1-9-20(28)12(27)6-15(37-9)38-14-8-26(35,25(33)34)7-11-17(14)24(32)19-18(22(11)30)21(29)10-4-3-5-13(36-2)16(10)23(19)31/h3-5,9,12,14-15,20,28,30,32,35H,6-8,27H2,1-2H3,(H,33,34)/t9?,12?,14?,15?,20?,26-/m0/s1
InChI Key:
UOZJSBYGENSCDJ-XYTOGJCHSA-N
Properties
Complexity:
962  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
529.158g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
529.498g/mol
Monoisotopic Mass:
529.158g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
206A^2
Undefined Atom Stereocenter Count:
5  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties