CHEBI:8333 - Populin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Populin
ChEBI ID CHEBI:8333
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H22O8
Net Charge 0
Average Mass 390.385
Monoisotopic Mass 390.131
InChI InChI=1S/C20H22O8/c21-10-13-8-4-5-9-14(13)27-20-18(24)17(23)16(22)15(28-20)11-26-19(25)12-6-2-1-3-7-12/h1-9,15-18,20-24H,10-11H2/t15-,16-,17+,18-,20-/m1/s1
InChIKey HHSKNLJWHGXWPK-BFMVXSJESA-N
SMILES C=1(O[C@H]2[C@@H]([C@H]([C@@H]([C@@H](COC(C3=CC=CC=C3)=O)O2)O)O)O)C(=CC=CC1)CO
ChEBI Ontology
Outgoing Populin (CHEBI:8333) is a glycoside (CHEBI:24400)
Synonyms Sources
6'-O-benzoylsalicin ChEBI
Populin KEGG COMPOUND
populoside ChEBI
Manual Xrefs Databases
83713 ChemSpider
C00002667 KNApSAcK
C10823 KEGG COMPOUND
View more database links
Registry Number Type Source
99-17-2 CAS Registry Number KEGG COMPOUND
Last Modified
22 June 2017