Neomethymycin
[CAS# 497-73-4]

Identification

• Name: Neomethymycin
• Synonyms: (3R,4S,5S,7R,9E,11R,12S)-4-[(2S,3R,4S,6R)-4-Dimethylamino-3-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-12-(1-Hydroxyethyl)-3,5,7,11-Tetramethyl-1-Oxacyclododec-9-Ene-2,8-Dione; (3R,4S,5S,7R,9E,11R,12S)-4-[[(2S,3R,4S,6R)-4-Dimethylamino-3-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-12-(1-Hydroxyethyl)-3,5,7,11-Tetramethyl-1-Oxacyclododec-9-Ene-2,8-Dione; (3R,4S,5S,7R,9E,11R,12S)-4-[(2S,3R,4S,6R)-4-Dimethylamino-3-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-12-(1-Hydroxyethyl)-3,5,7,11-Tetramethyl-1-Oxacyclododec-9-Ene-2,8-Quinone
• Molecular Formula: C₂₅H₄₃NO₇
• Molecular Weight: 469.62
• CAS Registry Number: 497-73-4
• SMILES: [C@@H]2(N(C)C)[C@@H](O)[C@H](O[C@H]1[C@H](C[C@@H](C)C(=O)\C=C\[C@H]([C@H](OC(=O)[C@@H]1C)[C@H](O)C)C)C)O[C@@H](C2)C
• InChI: 1S/C25H43NO7/c1-13-9-10-20(28)14(2)11-15(3)22(17(5)24(30)32-23(13)18(6)27)33-25-21(29)19(26(7)8)12-16(4)31-25/h9-10,13-19,21-23,25,27,29H,11-12H2,1-8H3/b10-9+/t13-,14-,15+,16-,17-,18-,19+,21-,22+,23+,25+/m1/s1
• InChIKey: UEIVQYHYALXCBD-OTUJEKPESA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 627.8±55.0°C at 760 mmHg (Cal.)
• Flash point: 333.5±31.5°C (Cal.)