(2S,3R)-1,2,3,4-Tetrahydro-2,3,5-Trihydroxy-7-Methoxy-2-Methyl-9,10-Anthracenedione
[CAS# 22350-90-9]

Identification

• Name: (2S,3R)-1,2,3,4-Tetrahydro-2,3,5-Trihydroxy-7-Methoxy-2-Methyl-9,10-Anthracenedione
• Synonyms: (2R,3S)-2,3,8-Trihydroxy-6-Methoxy-3-Methyl-2,4-Dihydro-1H-Anthracene-9,10-Quinone; 9,10-Anthracenedione, 1,2,3,4-Tetrahydro-2,3,5-Trihydroxy-7-Methoxy-2-Methyl-, (2S,3R)-; 9,10-Anthracenedione, 1,2,3,4-Tetrahydro-2,3,5-Trihydroxy-7-Methoxy-2-Methyl-, (2S-Cis)-
• Molecular Formula: C₁₆H₁₆O₆
• Molecular Weight: 304.30
• CAS Registry Number: 22350-90-9 (52212-96-1)
• SMILES: [C@@]3([C@@H](CC2=C(C(=O)C1=CC(=CC(=C1C2=O)O)OC)C3)O)(O)C
• InChI: 1S/C16H16O6/c1-16(21)6-10-8(5-12(16)18)15(20)13-9(14(10)19)3-7(22-2)4-11(13)17/h3-4,12,17-18,21H,5-6H2,1-2H3/t12-,16+/m1/s1
• InChIKey: AAHQQIFXAQHGBD-WBMJQRKESA-N

Properties

• Density: 1.509g/cm³ (Cal.)
• Boiling point: 597.39°C at 760 mmHg (Cal.)
• Flash point: 226.338°C (Cal.)