Epihygromycin
[CAS# 75081-92-4]

Identification

• Name: Epihygromycin
• Synonyms: (E)-N-[(3As,4R,5R,6S,7R,7Ar)-4,6,7-Trihydroxy-3A,4,5,6,7,7A-Hexahydro-1,3-Benzodioxol-5-Yl]-3-[4-[(2S,3S,4S,5R)-5-Acetyl-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Oxy-3-Hydroxy-Phenyl]-2-Methyl-Prop-2-Enamide; (E)-N-[(3As,4R,5R,6S,7R,7Ar)-4,6,7-Trihydroxy-3A,4,5,6,7,7A-Hexahydro-1,3-Benzodioxol-5-Yl]-3-[4-[[(2S,3S,4S,5R)-5-Acetyl-3,4-Dihydroxy-2-Tetrahydrofuranyl]Oxy]-3-Hydroxyphenyl]-2-Methylprop-2-Enamide; (E)-N-[(3As,4R,5R,6S,7R,7Ar)-4,6,7-Trihydroxy-3A,4,5,6,7,7A-Hexahydro-1,3-Benzodioxol-5-Yl]-3-[4-[(2S,3S,4S,5R)-5-Acetyl-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Oxy-3-Hydroxy-Phenyl]-2-Methyl-Acrylamide
• Molecular Formula: C₂₃H₂₉NO₁₂
• Molecular Weight: 511.48
• CAS Registry Number: 75081-92-4
• SMILES: [C@@H]14OCO[C@@H]1[C@H](O)[C@@H](O)[C@@H](NC(=O)C(=C/C3=CC(=C(O[C@@H]2O[C@H]([C@@H](O)[C@@H]2O)C(=O)C)C=C3)O)/C)[C@H]4O
• InChI: 1S/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18+,19+,20+,21-,23-/m1/s1
• InChIKey: YQYJSBFKSSDGFO-SQTRDLTCSA-N

Properties

• Density: 1.603g/cm³ (Cal.)
• Boiling point: 925.546°C at 760 mmHg (Cal.)
• Flash point: 513.552°C (Cal.)