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CHEBI:145199 - Kuguaglycoside E

ChEBI IDCHEBI:145199
ChEBI NameKuguaglycoside E
Stars
Submittermwilliams
DownloadsMolfile
FormulaC42H70O14
Net Charge0
Average Mass799.008
Monoisotopic Mass798.47656
SMILES[H][C@@]12[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C3C(C)(C)[C@@H](O)CC[C@@]3([H])[C@]1(CO)CC[C@@]1(C)[C@@]2(C)CC[C@]1([H])[C@H](C)CC(C=C(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C42H70O14/c1-20(2)14-22(53-37-34(51)32(49)30(47)27(17-43)55-37)15-21(3)23-10-11-41(7)36-26(54-38-35(52)33(50)31(48)28(18-44)56-38)16-25-24(8-9-29(46)39(25,4)5)42(36,19-45)13-12-40(23,41)6/h14,16,21-24,26-38,43-52H,8-13,15,17-19H2,1-7H3/t21-,22?,23-,24-,26+,27-,28-,29+,30-,31-,32+,33+,34-,35-,36+,37-,38-,40-,41+,42-/m1/s1
InChIKeyLSBBAHYFHCJMIN-DJDUJDLESA-N
Species of MetaboliteComponentSourceComments
Momordica charantia (ncbitaxon:3673) seed (BTO:0001226) MetaboLights (MTBLS701)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Kuguaglycoside E (CHEBI:145199) is a 3-hydroxy steroid (CHEBI:36834)
Kuguaglycoside E (CHEBI:145199) is a steroid saponin (CHEBI:61655)
Kuguaglycoside E (CHEBI:145199) is a β-D-glucoside (CHEBI:22798)