Monic Acid A
[CAS# 66262-68-8]

Identification

• Name: Monic Acid A
• Synonyms: (E)-4-[(2S,3S,4S,5R)-3,4-Dihydroxy-5-[[3-[(1S)-2-Hydroxy-1-Methyl-Propyl]Oxiran-2-Yl]Methyl]Tetrahydropyran-2-Yl]-3-Methyl-But-2-Enoic Acid; (E)-4-[(2S,3S,4S,5R)-3,4-Dihydroxy-5-[[3-[(1S)-2-Hydroxy-1-Methylpropyl]-2-Oxiranyl]Methyl]-2-Tetrahydropyranyl]-3-Methylbut-2-Enoic Acid; (E)-4-[(2S,3S,4S,5R)-3,4-Dihydroxy-5-[[3-[(2S)-3-Hydroxybutan-2-Yl]Oxiran-2-Yl]Methyl]Oxan-2-Yl]-3-Methyl-But-2-Enoic Acid
• Molecular Formula: C₁₇H₂₈O₇
• Molecular Weight: 344.40
• CAS Registry Number: 66262-68-8
• SMILES: [C@H]2(CC1OC1[C@H](C(O)C)C)[C@H](O)[C@H](O)[C@@H](OC2)C\C(=C\C(=O)O)C
• InChI: 1S/C17H28O7/c1-8(5-14(19)20)4-12-16(22)15(21)11(7-23-12)6-13-17(24-13)9(2)10(3)18/h5,9-13,15-18,21-22H,4,6-7H2,1-3H3,(H,19,20)/b8-5+/t9-,10?,11+,12-,13?,15-,16+,17?/m0/s1
• InChIKey: IUBMRJVNZLQSHU-VPUSNWGPSA-N

Properties

• Density: 1.271g/cm³ (Cal.)
• Boiling point: 566.344°C at 760 mmHg (Cal.)
• Flash point: 202.574°C (Cal.)