Apogossypol structure

Apogossypol

3-methyl-5-propan-2-yl-2-(1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)naphthalene-1,6,7-triol

Also Known As: Apogossypol|(+)-Apogossypol|(S)-Apogossypol|(R)-Apogossypol|Apogossypol;NSC736630|Apogossypol; NSC736630|CNDO-103|5,5'-Diisopropyl-3,3'-dimethyl-[2,2'-binaphthalene]-1,1',6,6',7,7'-hexaol|Racemic Apogossypol, stabilized with ascorbic acid|3-methyl-5-propan-2-yl-2-(1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)naphthalene-1,6,7-triol|(2,2'-Binaphthalene)-1,1',6,6',7,7'-hexol, 5,5'-diisopropyl-3,3'-dimethyl-|3,3'-dimethyl-5,5'-bis(propan-2-yl)-[2,2'-binaphthalene]-1,1',6,6',7,7'-hexol|3-methyl-5-propan-2-yl-2-(1,6,7-trihydroxy-3-methyl-5-propan|5,5'-Diisopropyl-3,3'-dimethyl-(2,2'-binaphthalene)-1,1',6,6',7,7'-hexol|(+)-5,5'-Diisopropyl-3,3'-dimethyl-[2,2']binaphthalenyl-1,6,7,1',6',7'-hexaol|(+/-)-5,5'-Diisopropyl-3,3'-dimethyl-[2,2']binaphthalenyl-1,6,7,1',6',7'-hexaol|(R)-5,5'-diisopropyl-3,3'-dimethyl-[2,2'-binaphthalene]-1,1',6,6',7,7'-hexaol|1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)-[2,2'-binaphthalene]|3,3'-Dimethyl-5,5'-di(propan-2-yl)[2,2'-binaphthalene]-1,1',6,6',7,7'-hexol|(+)-3,3 -Dimethyl-5,5 -bis(1-methylethyl)-2,2 -binaphthalene-1,1 ,6,6 ,7,7 -hexol|5-isopropyl-3-methyl-2-(1,6,7-trihydroxy-5-isopropyl-3-methyl-2-naphthyl)naphthalene-1,6,7-triol

CAS: 784206-41-3
Molecular Formula C28H30O6
Molecular Weight 462.20422 g/mol
LogP 6.9
Topological Polar Surface Area 121.0 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 462.20422
Monoisotopic Mass 462.20422
Heavy Atoms 34
Complexity 640.0

Chemical Identifiers

CAS Number 784206-41-3
SMILES CC1=CC2=C(C(=C(C=C2C(=C1C3=C(C4=CC(=C(C(=C4C=C3C)C(C)C)O)O)O)O)O)O)C(C)C
InChIKey PBJKWGWHZVXBGU-UHFFFAOYSA-N

Product Overview

Apogossypol (CAS 784206-41-3), with molecular formula C28H30O6 and molecular weight 462.20422 g/mol. IUPAC: 3-methyl-5-propan-2-yl-2-(1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)naphthalene-1,6,7-triol.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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