EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:19593 - 2-hydroxy-1-phenanthryl β-D-glucopyranoside

ChEBI IDCHEBI:19593
ChEBI Name2-hydroxy-1-phenanthryl β-D-glucopyranoside
Stars
ASCII Name2-hydroxy-1-phenanthryl beta-D-glucopyranoside
Last Modified4 January 2007
DownloadsMolfile
FormulaC20H20O7
Net Charge0
Average Mass372.373
Monoisotopic Mass372.12090
SMILESOC[C@H]1O[C@@H](Oc2c(O)ccc3c2ccc2ccccc23)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C20H20O7/c21-9-15-16(23)17(24)18(25)20(26-15)27-19-13-6-5-10-3-1-2-4-11(10)12(13)7-8-14(19)22/h1-8,15-18,20-25H,9H2/t15-,16-,17+,18-,20+/m1/s1
InChIKeyRZPVCCLYHPVIAO-NUABRCLCSA-N
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-1-phenanthryl β-D-glucopyranoside (CHEBI:19593) has functional parent phenanthrene-1,2-diol (CHEBI:37452)
2-hydroxy-1-phenanthryl β-D-glucopyranoside (CHEBI:19593) is a phenanthryl β-D-glucopyranoside (CHEBI:25963)
IUPAC Name 
2-hydroxyphenanthren-1-yl β-D-glucopyranoside
Synonym  Source
2-Hydroxy-1-phenanthryl-beta-D-glucopyranosideUM-BBD
Manual XrefsDatabases
c0547UM-BBD