Naringin Dihydrochalcone

CAS	18916-17-1
Structure
Synonyms	Senior saccharin
IUPAC Name	1-[4-[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
Molecular Weight	582.56
Molecular Formula	C27H34O14
Canonical SMILES	CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C(C(=C3)O)C(=O)CCC4=CC=C(C=C4)O)O)CO)O)O)O)O)O
InChI	InChI=1S/C27H34O14/c1-11-20(33)22(35)24(37)26(38-11)41-25-23(36)21(34)18(10-28)40-27(25)39-14-8-16(31)19(17(32)9-14)15(30)7-4-12-2-5-13(29)6-3-12/h2-3,5-6,8-9,11,18,20-29,31-37H,4,7,10H2,1H3/t11-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
InChI Key	CWBZAESOUBENAP-QVNVHUMTSA-N
Boiling Point	916.8±65.0 °C
Melting Point	131-132 °C
Flash Point	302.7 °C
Purity	95%
Density	1.63±0.1 g/cm³
Refractive Index	1.696
pKa	6.85±0.40(Predicted)
Appearance	White to off-white powder