CAS Registry Number®
40246-10-4
CAS Name
Glycitin
Molecular Formula
C22H22O10
Molecular Mass
446.40
Compound Properties
-
Melting Point (1)
203-204 °C
Source(s)
- (1) Al-Maharik, Nawaf; European Journal of Organic Chemistry, (2008), (33), 5622-5629, CAplus
Other Names and Identifiers
InChI
InChI=1S/C22H22O10/c1-29-15-6-12-14(30-9-13(18(12)25)10-2-4-11(24)5-3-10)7-16(15)31-22-21(28)20(27)19(26)17(8-23)32-22/h2-7,9,17,19-24,26-28H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1
InChIKey
InChIKey=OZBAVEKZGSOMOJ-MIUGBVLSSA-N
SMILES
O=C1C=2C(=CC(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(OC)C2)OC=C1C4=CC=C(O)C=C4
Canonical SMILES
O=C1C(=COC=2C=C(OC3OC(CO)C(O)C(O)C3O)C(OC)=CC12)C=4C=CC(O)=CC4
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-6-methoxy-
- 7-(β-D-Glucopyranosyloxy)-3-(4-hydroxyphenyl)-6-methoxy-4H-1-benzopyran-4-one
- Glycitein 7-O-β-glucoside
- Glycitein 7-O-glucoside
- Glycitein-7-β-O-glucoside
- Glycitin
