CHEBI:3685 - Chryso-obtusin glucoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Chryso-obtusin glucoside
ChEBI ID CHEBI:3685
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H28O12
Net Charge 0
Average Mass 520.484
Monoisotopic Mass 520.15808
InChI InChI=1S/C25H28O12/c1-9-6-10-14(18(29)15-11(16(10)27)7-12(32-2)22(33-3)24(15)35-5)23(34-4)21(9)37-25-20(31)19(30)17(28)13(8-26)36-25/h6-7,13,17,19-20,25-26,28,30-31H,8H2,1-5H3/t13-,17-,19+,20-,25+/m1/s1
InChIKey QBFJCZWBSLFTEE-UWBHIVAPSA-N
SMILES COc1cc2C(=O)c3cc(C)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3C(=O)c2c(OC)c1OC
ChEBI Ontology
Outgoing Chryso-obtusin glucoside (CHEBI:3685) is a anthraquinone (CHEBI:22580)
Synonym Source
Chryso-obtusin glucoside KEGG COMPOUND
Manual Xrefs Databases
C00002805 KNApSAcK
C10313 KEGG COMPOUND
View more database links
Registry Number Type Source
96820-54-1 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014