2-Hydroxy-N-[(1R,6S)-1-(Hydroxymethyl)-2,5-Dioxo-7-Oxabicyclo[4.1.0]Hept-3-En-4-Yl]Benzamide
[CAS# 175448-32-5]

Identification

• Name: 2-Hydroxy-N-[(1R,6S)-1-(Hydroxymethyl)-2,5-Dioxo-7-Oxabicyclo[4.1.0]Hept-3-En-4-Yl]Benzamide
• Synonyms: N-[(1R,6S)-2,5-Diketo-1-Methylol-7-Oxabicyclo[4.1.0]Hept-3-En-4-Yl]-2-Hydroxy-Benzamide; Benzamide, 2-Hydroxy-N-(6-(Hydroxymethyl)-2,5-Dioxo-7-Oxabicyclo(4.1.0)Hept-3-En-3-Yl)-, (1S)-; Epoxyquinomicin B
• Molecular Formula: C₁₄H₁₁NO₆
• Molecular Weight: 289.24
• CAS Registry Number: 175448-32-5
• SMILES: [C@]13([C@@H](C(=O)C(=CC1=O)NC(C2=C(O)C=CC=C2)=O)O3)CO
• InChI: 1S/C14H11NO6/c16-6-14-10(18)5-8(11(19)12(14)21-14)15-13(20)7-3-1-2-4-9(7)17/h1-5,12,16-17H,6H2,(H,15,20)/t12-,14+/m1/s1
• InChIKey: VIGCRVLJRHAWJR-OCCSQVGLSA-N

Properties

• Density: 1.63g/cm³ (Cal.)
• Boiling point: 625.718°C at 760 mmHg (Cal.)
• Flash point: 332.223°C (Cal.)