1-O-[(8-Anilino-8-oxooctanoyl)amino]-beta-D-glucopyranuronic acid
[CAS# 863456-50-2]

Identification

• Name: 1-O-[(8-Anilino-8-oxooctanoyl)amino]-beta-D-glucopyranuronic acid
• Synonyms: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(7-phenylcarbamoyl-heptanoylaminooxy)-tetrahydro-pyran-2-carboxylic acid; Suberoylanilide hydroxamic acid ¦Â-D-glucuronide
• Molecular Formula: C₂₀H₂₈N₂O₉
• Molecular Weight: 440.44
• CAS Registry Number: 863456-50-2
• SMILES: C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
• InChI: 1S/C20H28N2O9/c23-13(21-12-8-4-3-5-9-12)10-6-1-2-7-11-14(24)22-31-20-17(27)15(25)16(26)18(30-20)19(28)29/h3-5,8-9,15-18,20,25-27H,1-2,6-7,10-11H2,(H,21,23)(H,22,24)(H,28,29)/t15-,16-,17+,18-,20-/m0/s1
• InChIKey: AGXZHORDQQELAH-JNIAIEOXSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Refractive index: 1.603 (Cal.)