Iremycin
[CAS# 75634-51-4]

Identification

• Name: Iremycin
• Synonyms: (9R,10R)-10-[(2S,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (9R,10R)-10-[[(2S,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-9-Ethyl-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (9R,10R)-10-[(2S,4S,5S,6S)-4-Dimethylamino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,6,9,11-Tetrahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₈H₃₃NO₉
• Molecular Weight: 527.57
• CAS Registry Number: 75634-51-4
• SMILES: [C@H]4(C3=C(C1=C(C(=O)C2=C(C1=O)C=CC=C2O)C(=C3CC[C@]4(O)CC)O)O)O[C@H]5C[C@H](N(C)C)[C@@H]([C@@H](O5)C)O
• InChI: 1S/C28H33NO9/c1-5-28(36)10-9-14-19(27(28)38-17-11-15(29(3)4)22(31)12(2)37-17)26(35)21-20(24(14)33)25(34)18-13(23(21)32)7-6-8-16(18)30/h6-8,12,15,17,22,27,30-31,33,35-36H,5,9-11H2,1-4H3/t12-,15-,17-,22+,27+,28+/m0/s1
• InChIKey: HECQIFUUJRYFRO-VMINLZLMSA-N

Properties

• Density: 1.495g/cm³ (Cal.)
• Boiling point: 709.682°C at 760 mmHg (Cal.)
• Flash point: 383.002°C (Cal.)