Obelmycin A
[CAS# 107807-18-1]

Identification

• Name: Obelmycin A
• Synonyms: 7-(4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-9-Ethyl-1,4,6,9,10,11-Hexahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-[(4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-9-Ethyl-1,4,6,9,10,11-Hexahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; 7-(4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-9-Ethyl-1,4,6,9,10,11-Hexahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₈H₃₃NO₁₁
• Molecular Weight: 559.57
• CAS Registry Number: 107807-18-1
• SMILES: C5=CC(=C4C(=O)C1=C(C(=C3C(=C1O)C(OC2OC(C(O)C(N(C)C)C2)C)CC(O)(C3O)CC)O)C(=O)C4=C5O)O
• InChI: 1S/C28H33NO11/c1-5-28(38)9-14(40-15-8-11(29(3)4)22(32)10(2)39-15)18-21(27(28)37)26(36)20-19(25(18)35)23(33)16-12(30)6-7-13(31)17(16)24(20)34/h6-7,10-11,14-15,22,27,30-32,35-38H,5,8-9H2,1-4H3
• InChIKey: UULLJCRFYRZYCE-UHFFFAOYSA-N

Properties

• Density: 1.611g/cm³ (Cal.)
• Boiling point: 716.44°C at 760 mmHg (Cal.)
• Flash point: 387.089°C (Cal.)