(7S)-7-[(1R,3S)-3,4-Dihydro-10-hydroxy-7,9-dimethoxy-1,3-dimethyl-1H-naphtho[2,3-c]pyran-5-yl]-3,4-dihydro-3,8,9-trihydroxy-3-methyl-1(2H)-Anthracenone
[CAS# 56678-09-2]

Identification

• Name: (7S)-7-[(1R,3S)-3,4-Dihydro-10-hydroxy-7,9-dimethoxy-1,3-dimethyl-1H-naphtho[2,3-c]pyran-5-yl]-3,4-dihydro-3,8,9-trihydroxy-3-methyl-1(2H)-Anthracenone
• Synonyms: Nsc235814; Toxin T 544; Tullidinol
• Molecular Formula: C₃₂H₃₂O₈
• Molecular Weight: 544.60
• CAS Registry Number: 56678-09-2
• SMILES: C2=C1CC(O)(C)CC(C1=C(C3=C(C(=CC=C23)C4=C6C(=C(O)C5=C(OC)C=C(C=C45)OC)C(C)OC(C6)C)O)O)=O
• InChI: 1S/C32H32O8/c1-14-8-20-24(15(2)40-14)30(35)28-21(10-18(38-4)11-23(28)39-5)27(20)19-7-6-16-9-17-12-32(3,37)13-22(33)25(17)31(36)26(16)29(19)34/h6-7,9-11,14-15,34-37H,8,12-13H2,1-5H3
• InChIKey: OFXNQLFWWFUNRK-UHFFFAOYSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 723.414°C at 760 mmHg (Cal.)
• Flash point: 235.421°C (Cal.)