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CHEBI:172751 - β-sitosterol 3-O-β-D-galactopyranoside

Default Structure
ChEBI IDCHEBI:172751
ChEBI Nameβ-sitosterol 3-O-β-D-galactopyranoside
Stars
ASCII Namebeta-sitosterol 3-O-beta-D-galactopyranoside
Last Modified8 January 2026
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H60O6
Net Charge0
Average Mass576.859
Monoisotopic Mass576.43899
SMILES[H][C@@]12CC=C3C[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC[C@@H](CC)C(C)C
InChIInChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30+,31+,32-,33-,34+,35-/m1/s1
InChIKeyNPJICTMALKLTFW-MXYGQONUSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
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)
β-sitosterol 3-O-β-D-galactopyranoside (CHEBI:172751) has functional parent sitosterol (CHEBI:27693)
β-sitosterol 3-O-β-D-galactopyranoside (CHEBI:172751) has parent hydride stigmastane (CHEBI:26773)
β-sitosterol 3-O-β-D-galactopyranoside (CHEBI:172751) is a monosaccharide derivative (CHEBI:63367)
β-sitosterol 3-O-β-D-galactopyranoside (CHEBI:172751) is a steroid saponin (CHEBI:61655)
β-sitosterol 3-O-β-D-galactopyranoside (CHEBI:172751) is a β-D-galactoside (CHEBI:28034)
IUPAC Name 
stigmast-5-en-3β-yl β-D-galactopyranoside
Synonyms  Source
3-O-β-D-galactopyranosyl-β-sitosterolChEBI
(3β)-stigmast-5-en-3-yl β-D-galactopyranosideChEBI
sitosterol 3-O-β-galactopyranosideChEBI
sitosterol-β-D-galactosideChEBI
β-sitosterol 3-β-D-galactopyranosideChEBI
β-sitosterol β-D-galactosideChEBI
Manual XrefsDatabases
103885036ChemSpider
HMDB0033949HMDB
LMST01040251LIPID MAPS
Registry NumbersSources
CAS:55057-29-9ChEBI