CHEBI:9046 - Scandoside methyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Scandoside methyl ester
ChEBI ID CHEBI:9046
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C17H24O11
Net Charge 0
Average Mass 404.367
Monoisotopic Mass 404.13186
InChI InChI=1S/C17H24O11/c1-25-15(24)7-5-26-16(10-6(3-18)2-8(20)11(7)10)28-17-14(23)13(22)12(21)9(4-19)27-17/h2,5,8-14,16-23H,3-4H2,1H3/t8-,9-,10-,11+,12-,13+,14-,16+,17+/m1/s1
InChIKey WSGPLSDARZNMCW-LPGRTNKPSA-N
SMILES COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1[C@H](O)C=C2CO
ChEBI Ontology
Outgoing Scandoside methyl ester (CHEBI:9046) is a terpene glycoside (CHEBI:61777)
Synonym Source
Scandoside methyl ester KEGG COMPOUND
Manual Xrefs Databases
C00003097 KNApSAcK
C09798 KEGG COMPOUND
View more database links
Registry Number Type Source
27530-67-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014