(3aR,12aR)-7-Chloro-3a,12a-dihydro-3a,4-dihydroxy-6-methoxy-5H-Furo[3',2':4,5]furo[3,2-b]xanthen-5-one
[CAS# 58775-49-8]

Identification

• Name: (3aR,12aR)-7-Chloro-3a,12a-dihydro-3a,4-dihydroxy-6-methoxy-5H-Furo[3',2':4,5]furo[3,2-b]xanthen-5-one
• Synonyms: 5H-Furo(3',2':4,5)Furo(3,2-B)Xanthen-5-One, 7-Chloro-3A,12A-Dihydro-3A,4-Dihydroxy-6-Methoxy-, (3Ar-Cis)-
• Molecular Formula: C₁₈H₁₁ClO₇
• Molecular Weight: 374.73
• CAS Registry Number: 58775-49-8
• SMILES: [C@@]45(C3=C(C1=C(OC2=C(C1=O)C(=C(C=C2)Cl)OC)C=C3O[C@H]4OC=C5)O)O
• InChI: 1S/C18H11ClO7/c1-23-16-7(19)2-3-8-12(16)14(20)11-9(25-8)6-10-13(15(11)21)18(22)4-5-24-17(18)26-10/h2-6,17,21-22H,1H3/t17-,18-/m1/s1
• InChIKey: SHQCFFLCIPXBLN-QZTJIDSGSA-N

Properties

• Density: 1.715g/cm³ (Cal.)
• Boiling point: 668.018°C at 760 mmHg (Cal.)
• Flash point: 357.805°C (Cal.)