3,4alpha-Dichloro-6,8-Dihydroxy-10alpha-[(2E)-6-Hydroxy-3,7-Dimethylocta-2,7-Dienyl]-2,2-Dimethyl-3,4-Dihydrobenzo[g]Chromene-5,10-Dione
[CAS# 111216-62-7]

Identification

• Name: 3,4alpha-Dichloro-6,8-Dihydroxy-10alpha-[(2E)-6-Hydroxy-3,7-Dimethylocta-2,7-Dienyl]-2,2-Dimethyl-3,4-Dihydrobenzo[g]Chromene-5,10-Dione
• Synonyms: 3,4A-Dichloro-6,8-Dihydroxy-10A-[(2E)-6-Hydroxy-3,7-Dimethyl-Octa-2,7-Dienyl]-2,2-Dimethyl-3,4-Dihydrobenzo[G]Chromene-5,10-Dione; 3,4A-Dichloro-6,8-Dihydroxy-10A-[(2E)-6-Hydroxy-3,7-Dimethyl-Octa-2,7-Dienyl]-2,2-Dimethyl-3,4-Dihydrobenzo[G]Chromene-5,10-Quinone; 16-Hydroxy-17-Methylenenapyradiomycin A1
• Molecular Formula: C₂₅H₃₀Cl₂O₆
• Molecular Weight: 497.41
• CAS Registry Number: 111216-62-7
• SMILES: C1=C(O)C=C(O)C3=C1C(=O)C2(OC(C(Cl)CC2(Cl)C3=O)(C)C)C\C=C(\CCC(O)C(=C)C)C
• InChI: 1S/C25H30Cl2O6/c1-13(2)17(29)7-6-14(3)8-9-25-21(31)16-10-15(28)11-18(30)20(16)22(32)24(25,27)12-19(26)23(4,5)33-25/h8,10-11,17,19,28-30H,1,6-7,9,12H2,2-5H3/b14-8+
• InChIKey: MUVCLXZNRJJIGV-RIYZIHGNSA-N

Properties

• Density: 1.357g/cm³ (Cal.)
• Boiling point: 682.644°C at 760 mmHg (Cal.)
• Flash point: 366.65°C (Cal.)