1-Acetyl-2,3-Dihydro-2,6,11-Trihydroxy-4,8,9,13-Tetramethoxy-2-Methyl-1H-Cyclohepta(ghi)Perylene-5,12-Dione Stereoisomer
[CAS# 124709-39-3]

Identification

• Name: 1-Acetyl-2,3-Dihydro-2,6,11-Trihydroxy-4,8,9,13-Tetramethoxy-2-Methyl-1H-Cyclohepta(ghi)Perylene-5,12-Dione Stereoisomer
• Synonyms: Shiraiachrome A; Shiraiachrome B; Shiraiachrome-A
• Molecular Formula: C₃₀H₂₆O₁₀
• Molecular Weight: 546.53
• CAS Registry Number: 124709-39-3
• SMILES: C6=C(OC)C3=C5C2=C1C4=C(C(O)(C(C1=C(OC)C(=O)C(=C2C=C3OC)O)C(=O)C)C)C=C(OC)C(=O)C4C5=C6O
• InChI: 1S/C30H26O10/c1-10(31)25-24-21-17-11(26(33)28(35)29(24)40-6)7-14(37-3)20-15(38-4)9-13(32)19(22(17)20)23-18(21)12(30(25,2)36)8-16(39-5)27(23)34/h7-9,23,25,32,36H,1-6H3,(H,33,35)
• InChIKey: HDPRGZPJFAJRLO-UHFFFAOYSA-N

Properties

• Density: 1.555g/cm³ (Cal.)
• Boiling point: 996.292°C at 760 mmHg (Cal.)
• Flash point: 333.62°C (Cal.)