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CHEBI:191973 - 16beta-Hydroxystellatogenin

Default Structure
ChEBI IDCHEBI:191973
ChEBI Name16beta-Hydroxystellatogenin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48O5
Net Charge0
Average Mass488.709
Monoisotopic Mass488.35017
SMILESCC(C)(O)C1C2CC3(C(=O)O2)C(O)CC2(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC42C)C13
InChIInChI=1S/C30H48O5/c1-25(2)18-10-13-28(6)19(27(18,5)12-11-20(25)31)9-8-16-22-23(26(3,4)34)17-14-30(22,24(33)35-17)21(32)15-29(16,28)7/h16-23,31-32,34H,8-15H2,1-7H3
InChIKeyTUGGKIJIUJBTCO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
ChEBI Ontology
Outgoing Relation(s)
16beta-Hydroxystellatogenin (CHEBI:191973) is a triterpenoid (CHEBI:36615)
IUPAC Name 
2,10-dihydroxy-19-(2-hydroxypropan-2-yl)-4,5,9,9,13-pentamethyl-21-oxahexacyclo[18.2.1.01,18.04,17.05,14.08,13]tricosan-22-one
Manual XrefsDatabases
HMDB0040391HMDB