Isatan B
[CAS# 20307-14-6]

Identification

• Name: Isatan B
• Synonyms: 1H-Indol-3-Yl (3S,4S,5R)-3,4,5-Trihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Carboxylate; (3S,4S,5R)-3,4,5-Trihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofurancarboxylic Acid 1H-Indol-3-Yl Ester; (3S,4S,5R)-3,4,5-Trihydroxy-5-Methylol-Tetrahydrofuran-2-Carboxylic Acid 1H-Indol-3-Yl Ester
• Molecular Formula: C₁₄H₁₅NO₇
• Molecular Weight: 309.28
• CAS Registry Number: 20307-14-6
• SMILES: [C@@H]1(O)[C@@](OC([C@H]1O)C(OC2=C[NH]C3=CC=CC=C23)=O)(O)CO
• InChI: 1S/C14H15NO7/c16-6-14(20)12(18)10(17)11(22-14)13(19)21-9-5-15-8-4-2-1-3-7(8)9/h1-5,10-12,15-18,20H,6H2/t10-,11?,12+,14-/m1/s1
• InChIKey: KGXOHVOUKNLUNP-VFJKSUPXSA-N

Properties

• Density: 1.687g/cm³ (Cal.)
• Boiling point: 624.495°C at 760 mmHg (Cal.)
• Flash point: 331.483°C (Cal.)