CHEBI:67236 - attenoside

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ChEBI Name attenoside
ChEBI ID CHEBI:67236
Definition An acyclic diterpene glycoside consisting of a 20-hydroxygeranyllinalool skeleton conjugated to two disaccharide units at C-3 and C-20.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C44H74O21
Net Charge 0
Average Mass 939.04580
Monoisotopic Mass 938.47226
InChI InChI=1S/C44H74O21/c1-7-44(6,65-42-37(57)34(54)38(27(19-47)62-42)63-40-35(55)31(51)28(48)24(5)59-40)16-10-15-22(3)12-8-11-21(2)13-9-14-23(4)20-58-43-39(33(53)30(50)26(18-46)61-43)64-41-36(56)32(52)29(49)25(17-45)60-41/h7,11,14-15,24-43,45-57H,1,8-10,12-13,16-20H2,2-6H3/b21-11+,22-15+,23-14-/t24-,25+,26+,27+,28-,29+,30+,31+,32-,33-,34+,35+,36+,37+,38+,39+,40-,41-,42-,43+,44+/m0/s1
InChIKey CWAXZXSFUDEMIX-ZIKBFGBNSA-N
SMILES C[C@@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@](C)(CC\C=C(/C)CC\C=C(/C)CC\C=C(\C)CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing attenoside (CHEBI:67236) has role metabolite (CHEBI:25212)
attenoside (CHEBI:67236) is a disaccharide derivative (CHEBI:63353)
attenoside (CHEBI:67236) is a diterpene glycoside (CHEBI:71939)
attenoside (CHEBI:67236) is a sophoroside (CHEBI:145470)
IUPAC Name
(2Z,6E,10E,14S)-14-{[4-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy}-2,6,10,14-tetramethylhexadeca-2,6,10,15-tetraen-1-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside
Registry Number Type Source
15811856 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
20081114 PubMed citation Europe PMC
20701244 PubMed citation Europe PMC
Last Modified
22 November 2019