Ararobinol structure

Ararobinol

10-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-1,8-dihydroxy-3-methyl-10H-anthracen-9-one

Also Known As: Ararobinol|Chrysarobin dimer|Anthraquinone Related Compound 1|chrysophanol-10,10'-bianthrone|NCI60_020619|10-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-1,8-dihydroxy-3-methyl-10H-anthracen-9-one|[9,9'-Bianthracene]-10,10'(9H,9'H)-dione, 4,4',5,5'-tetrahydroxy-2,2'-dimethyl-|(10alpha,10 alpha)-2,2 -Dimethyl-4,4 ,5,5 -tetrahydroxy-9,9 -bianthracene-10,10 (9H,9 H)-dione|(10alpha,10 beta)-2,2 -Dimethyl-4,4 ,5,5 -tetrahydroxy-9,9 -bianthracene-10,10 (9H,9 H)-dione|2,2 -Dimethyl-4,4 ,5,5 -tetrahydroxy-9,9 -bianthracene-10,10 (9H,9 H)-dione|3,3 -Dimethyl-1,1 ,8,8 -tetrahydroxy-10,10 -bianthracene-9,9 (10H,10 H)-dione|4,4',5,5'-tetrahydroxy-2,2'-dimethyl-9H,9'H,10H,10'H-[9,9'-bianthracene]-10,10'-dione

CAS: 17062-54-3
Molecular Formula C30H22O6
Molecular Weight 478.14163 g/mol
LogP 6.5
Topological Polar Surface Area 115.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
Rotatable Bonds 1
Exact Mass 478.14163
Monoisotopic Mass 478.14163
Heavy Atoms 36
Complexity 804.0

Chemical Identifiers

CAS Number 17062-54-3
SMILES CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C)C=CC=C3O
InChIKey IXXWTERKUADIKZ-UHFFFAOYSA-N

Product Overview

Ararobinol (CAS 17062-54-3), with molecular formula C30H22O6 and molecular weight 478.14163 g/mol. IUPAC: 10-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-1,8-dihydroxy-3-methyl-10H-anthracen-9-one.

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