Ferensimycin B
[CAS# 83852-60-2]

Identification

• Name: Ferensimycin B
• Synonyms: (2S)-2-[(2R,3R,5S,6S)-6-[(1S,2S,3S,5R)-5-[(2S,3S,5S)-5-[(2R,3R,5R)-5-Ethyl-2-Hydroxy-5-[(1S)-1-Hydroxypropyl]-3-Methyl-Tetrahydrofuran-2-Yl]-3,5-Dimethyl-Tetrahydrofuran-2-Yl]-2-Hydroxy-1,3-Dimethyl-4-Oxo-Heptyl]-2-Hydroxy-3,5-Dimethyl-Tetrahydropyran-2-Yl]Propanoic Acid; (2S)-2-[(2R,3R,5S,6S)-6-[(1S,2S,3S,5R)-5-[(2S,3S,5S)-5-[(2R,3R,5R)-5-Ethyl-2-Hydroxy-5-[(1S)-1-Hydroxypropyl]-3-Methyl-2-Tetrahydrofuranyl]-3,5-Dimethyl-2-Tetrahydrofuranyl]-2-Hydroxy-1,3-Dimethyl-4-Oxoheptyl]-2-Hydroxy-3,5-Dimethyl-2-Tetrahydropyranyl]Propanoic Acid; (2S)-2-[(2R,3R,5S,6S)-6-[(1S,2S,3S,5R)-5-[(2S,3S,5S)-5-[(2R,3R,5R)-5-Ethyl-2-Hydroxy-5-[(1S)-1-Hydroxypropyl]-3-Methyl-Tetrahydrofuran-2-Yl]-3,5-Dimethyl-Tetrahydrofuran-2-Yl]-2-Hydroxy-4-Keto-1,3-Dimethyl-Heptyl]-2-Hydroxy-3,5-Dimethyl-Tetrahydropyran-2-Yl]Propionic Acid
• Molecular Formula: C₃₅H₆₂O₁₀
• Molecular Weight: 642.87
• CAS Registry Number: 83852-60-2
• SMILES: [C@]1(O[C@](C[C@H]1C)([C@@H](O)CC)CC)(O)[C@]2(O[C@@H]([C@H](C2)C)[C@H](C(=O)[C@H]([C@@H](O)[C@@H]([C@H]3O[C@](O)([C@@H](C[C@@H]3C)C)[C@@H](C(=O)O)C)C)C)CC)C
• InChI: 1S/C35H62O10/c1-12-25(30-19(5)16-32(11,43-30)35(42)21(7)17-33(14-3,45-35)26(36)13-2)28(38)22(8)27(37)23(9)29-18(4)15-20(6)34(41,44-29)24(10)31(39)40/h18-27,29-30,36-37,41-42H,12-17H2,1-11H3,(H,39,40)/t18-,19-,20+,21+,22-,23-,24+,25-,26-,27+,29-,30-,32-,33+,34+,35+/m0/s1
• InChIKey: VXCHOKYIQWIIJX-BFXJAOHTSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 753.571°C at 760 mmHg (Cal.)
• Flash point: 224.971°C (Cal.)