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CHEBI:191992 - (3beta,4alpha,5alpha,23E)-4-Methylergosta-7,23-dien-3-ol

ChEBI IDCHEBI:191992
ChEBI Name(3beta,4alpha,5alpha,23E)-4-Methylergosta-7,23-dien-3-ol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H48O
Net Charge0
Average Mass412.702
Monoisotopic Mass412.37052
SMILESC/C(=C\CC(C)C1CCC2C3=CCC4C(C)C(O)CCC4(C)C3CCC21C)C(C)C
InChIInChI=1S/C29H48O/c1-18(2)19(3)8-9-20(4)23-12-13-25-22-10-11-24-21(5)27(30)15-17-29(24,7)26(22)14-16-28(23,25)6/h8,10,18,20-21,23-27,30H,9,11-17H2,1-7H3/b19-8+
InChIKeyCTWRZEHGRSDRPG-UFWORHAWSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
ChEBI Ontology
Outgoing Relation(s)
(3beta,4alpha,5alpha,23E)-4-Methylergosta-7,23-dien-3-ol (CHEBI:191992) is a ergostanoid (CHEBI:50403)
IUPAC Name 
17-[(E)-5,6-dimethylhept-4-en-2-yl]-4,10,13-trimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Manual XrefsDatabases
HMDB0033869HMDB