6,11-Dihydroxy-3,3-dimethyl-5-(3-methylbut-2-enyl)-12H-pyrano[6,5-c]acridin-7-one
[CAS# 56296-87-8]

Identification

• Name: 6,11-Dihydroxy-3,3-dimethyl-5-(3-methylbut-2-enyl)-12H-pyrano[6,5-c]acridin-7-one
• Synonyms: 7H-Pyrano(2,3-C)Acridin-7-One, 3,12-Dihydro-6,11-Dihydroxy-3,3-Dimethyl-5-(3-Methyl-2-Butenyl)-; Atalaphillinine
• Molecular Formula: C₂₃H₂₃NO₄
• Molecular Weight: 377.44
• CAS Registry Number: 56296-87-8
• SMILES: C1=CC=C(C4=C1C(C2=C(C3=C(C(=C2O)CC=C(C)C)OC(C)(C)C=C3)N4)=O)O
• InChI: 1S/C23H23NO4/c1-12(2)8-9-15-21(27)17-19(14-10-11-23(3,4)28-22(14)15)24-18-13(20(17)26)6-5-7-16(18)25/h5-8,10-11,25,27H,9H2,1-4H3,(H,24,26)
• InChIKey: QJMYUQUOPGKBEZ-UHFFFAOYSA-N

Properties

• Density: 1.255g/cm³ (Cal.)
• Boiling point: 569.184°C at 760 mmHg (Cal.)
• Flash point: 298.032°C (Cal.)