CHEBI:133468 - brassinolide 23-O-α-D-glucoside

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ChEBI Name brassinolide 23-O-α-D-glucoside
ChEBI ID CHEBI:133468
ChEBI ASCII Name brassinolide 23-O-alpha-D-glucoside
Definition A brassinosteroid that is brassinolide carrying an α-D-glucosyl residue at position O-23.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C34H58O11
Net Charge 0
Average Mass 642.819
Monoisotopic Mass 642.39791
InChI InChI=1S/C34H58O11/c1-15(2)16(3)30(45-32-29(41)28(40)27(39)25(13-35)44-32)26(38)17(4)19-7-8-20-18-14-43-31(42)22-11-23(36)24(37)12-34(22,6)21(18)9-10-33(19,20)5/h15-30,32,35-41H,7-14H2,1-6H3/t16-,17-,18-,19+,20-,21-,22+,23-,24+,25+,26+,27+,28-,29+,30+,32+,33+,34+/m0/s1
InChIKey ZGXCUMDOLQMEFX-WHNRJDMXSA-N
SMILES C1[C@]2([C@]3([H])COC([C@@]4([C@@]([C@]3(CC[C@@]2([C@](C1)([C@@H]([C@H]([C@@H]([C@H](C(C)C)C)O[C@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)CO)O)C)[H])C)[H])(C[C@H]([C@H](C4)O)O)C)[H])=O)[H]
Metabolite of Species Details
Arabidopsis thaliana (NCBI:txid3702) See: MetaboLights Study
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing brassinolide 23-O-α-D-glucoside (CHEBI:133468) has functional parent brassinolide (CHEBI:28277)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) has role plant metabolite (CHEBI:76924)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) is a α-D-glucoside (CHEBI:22390)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) is a 2α-hydroxy steroid (CHEBI:36858)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) is a 22-hydroxy steroid (CHEBI:36863)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) is a 3α-hydroxy steroid (CHEBI:36835)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) is a brassinosteroid (CHEBI:22921)
brassinolide 23-O-α-D-glucoside (CHEBI:133468) is a steroid saponin (CHEBI:61655)
IUPAC Name
(2S,3R,4R,5S)-2-[(3aS,5S,6R,7aR,7bS,9aS,10R,12aS,12bS)-5,6-dihydroxy-7a,9a-dimethyl-3-oxohexadecahydro-1H-benzo[c]indeno[5,4-e]oxepin-10-yl]-3-hydroxy-5,6-dimethylheptan-4-yl α-D-glucopyranoside
Synonyms Sources
brassinolide 23-O-α-glucoside ChEBI
brassinolide 23-O-glucoside ChEBI
brassinolide-23-O-glucoside MetaCyc
Manual Xref Database
brassinolide-23-O-glucoside MetaCyc
View more database links
Last Modified
13 March 2017