p-Aminophenyl β-D-lactopyranoside

Catalog	BBC17691020
CAS	17691-02-0
Structure
Synonyms	4-Aminophenyl-beta-D-lactopyranoside
IUPAC Name	(2S,3R,4S,5R,6R)-2-[(2R,3S,4R,5R,6S)-6-(4-aminophenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Weight	433.41
Molecular Formula	C18H27NO11
Canonical SMILES	C1=CC(=CC=C1N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O)O
InChI	InChI=1S/C18H27NO11/c19-7-1-3-8(4-2-7)27-17-15(26)13(24)16(10(6-21)29-17)30-18-14(25)12(23)11(22)9(5-20)28-18/h1-4,9-18,20-26H,5-6,19H2/t9-,10-,11+,12+,13-,14-,15-,16-,17-,18+/m1/s1
InChI Key	OCHWUNNDLIWPAO-MUKCROHVSA-N
Melting Point	200-204 °C
Purity	98%
Appearance	White to off-white solid
Solubility in Water	Slightly