Compound Selection

Formula: C21H22O9

MW: 418.4

MDL: MFCD09699810

TNP:

LogP: -1.2

LogS: -2.12

Acceptors: 9

Donors: 5

Rotation Bonds: 8

Chiral Centers: 6

N+O: 9

LIPINSKY: 4

IUPAC: 2-(4-hydroxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)(2H-3,4,5,6-tetrahydr opyran-2-yloxy)]chroman-4-one

Smiles: OCC1OC(C(C(C1O)O)O)Oc1ccc2C(=O)CC(c3ccc(O)cc3)Oc2c1

SOURCE: A flavone glycoside isolated from licorice

Chemical Compounds - Natural Compounds

Structure Search Shop Online Download Databases Request a CD
Structure Search eChemStore Download Request CD

Site Search

Compound Search

share

FacebookTwitterLinkedin

Contact Us

Phone: 302-292-8500
Fax: 302-292-8520

MyriaScreen II – diversity screening library from Sigma-Aldrich and TimTec
ApexScreen is a collection of 5,040 compounds that were selected to represent the diversity of TimTec stock
Chemistry reagents, HPLC columns, natural compounds
innovative software packages for chemical database management, chemical web server, structure drawing, diversity analysis, clustering, HTS and combinatorial chemistry, prediction of LogP/solubility/Pk, and Spectra Management