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CHEBI:191983 - Amasterol

ChEBI IDCHEBI:191983
ChEBI NameAmasterol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H44O2
Net Charge0
Average Mass412.658
Monoisotopic Mass412.33413
SMILESC=C(CCC(C)(O)C1CCC2C3=CC=C4CC(O)CCC4(C)C3CCC21C)C(C)C
InChIInChI=1S/C28H44O2/c1-18(2)19(3)11-16-28(6,30)25-10-9-23-22-8-7-20-17-21(29)12-14-26(20,4)24(22)13-15-27(23,25)5/h7-8,18,21,23-25,29-30H,3,9-17H2,1-2,4-6H3
InChIKeyVRCVXRWYXYWACO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
ChEBI Ontology
Outgoing Relation(s)
Amasterol (CHEBI:191983) is a ergostanoid (CHEBI:50403)
IUPAC Name 
17-(2-hydroxy-6-methyl-5-methylideneheptan-2-yl)-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
HMDB0030054HMDB