Griseolic Acid B
[CAS# 98890-01-8]

Identification

• Name: Griseolic Acid B
• Synonyms: 2-(6-Amino-9-Purinyl)-5-(Carboxymethyl)-3-Hydroxy-3,3A-Dihydro-2H-Furo[5,4-D]Furan-5-Carboxylic Acid; Griseolic Acid B; Beta-D-Ribo-Oct-4-Enofuranuronic Acid, 1-(6-Amino-9H-Purin-9-Yl)-3,6-Anhydro-6-C-Carboxy-1,5,7-Trideoxy-
• Molecular Formula: C₁₄H₁₃N₅O₇
• Molecular Weight: 363.29
• CAS Registry Number: 98890-01-8
• SMILES: C1=NC4=C([N]1C3OC2=CC(OC2C3O)(C(=O)O)CC(=O)O)N=CN=C4N
• InChI: 1S/C14H13N5O7/c15-10-7-11(17-3-16-10)19(4-18-7)12-8(22)9-5(25-12)1-14(26-9,13(23)24)2-6(20)21/h1,3-4,8-9,12,22H,2H2,(H,20,21)(H,23,24)(H2,15,16,17)
• InChIKey: WRHIKWNGCJVUOW-UHFFFAOYSA-N

Properties

• Density: 2.133g/cm³ (Cal.)
• Boiling point: 889.209°C at 760 mmHg (Cal.)
• Flash point: 491.576°C (Cal.)