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CHEBI:20760 - 6α-hydroxycastasterone

ChEBI IDCHEBI:20760
ChEBI Name6α-hydroxycastasterone
Stars
ASCII Name6alpha-hydroxycastasterone
DefinitionA brassinosteroid that is castasterone in which the oxo group at position 6 has been converted to a hydroxy group (the 6α-stereoisomer).
Secondary ChEBI IDCHEBI:80098
Last Modified6 January 2022
DownloadsMolfile
FormulaC28H50O5
Net Charge0
Average Mass466.703
Monoisotopic Mass466.36582
SMILES[H][C@@]12C[C@H](O)[C@@]3([H])C[C@H](O)[C@H](O)C[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)C(C)C
InChIInChI=1S/C28H50O5/c1-14(2)15(3)25(32)26(33)16(4)18-7-8-19-17-11-22(29)21-12-23(30)24(31)13-28(21,6)20(17)9-10-27(18,19)5/h14-26,29-33H,7-13H2,1-6H3/t15-,16-,17-,18+,19-,20-,21+,22-,23-,24+,25+,26+,27+,28+/m0/s1
InChIKeyCVXIEYXJQSRIAC-KLUYZAHOSA-N
Species of MetaboliteComponentSourceComments
Solanum lycopersicum (ncbitaxon:4081) - DOI (10.1002/chin.200322270) Species also known as Lycopersicon esculentum.
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
6α-hydroxycastasterone (CHEBI:20760) has functional parent castasterone (CHEBI:23051)
6α-hydroxycastasterone (CHEBI:20760) has role plant metabolite (CHEBI:76924)
6α-hydroxycastasterone (CHEBI:20760) is a 22-hydroxy steroid (CHEBI:36863)
6α-hydroxycastasterone (CHEBI:20760) is a 23-hydroxy steroid (CHEBI:36866)
6α-hydroxycastasterone (CHEBI:20760) is a 2α-hydroxy steroid (CHEBI:36858)
6α-hydroxycastasterone (CHEBI:20760) is a 3α-hydroxy steroid (CHEBI:36835)
6α-hydroxycastasterone (CHEBI:20760) is a 6α-hydroxy steroid (CHEBI:36850)
6α-hydroxycastasterone (CHEBI:20760) is a brassinosteroid (CHEBI:22921)
IUPAC Name 
(22R,23R,24S)-5α-ergostane-2α,3α,6α,22,23-pentol
Synonyms  Source
6α-HydroxycastasteroneLIPID MAPS
6α-hydroxy-6-deoxocastasteroneChEBI
6α-hydroxy-castasteroneKEGG COMPOUND
campestan-2α,3α,6α,22R,23R-pentolLIPID MAPS
UniProt Name  Source
6α-hydroxycastasteroneUniProt
Manual XrefsDatabases
LMST01030128LIPID MAPS
C00007522KNApSAcK
C15803KEGG COMPOUND
CPD-724MetaCyc
21864868ChemSpider
FDB030613FooDB
Registry NumbersSources
Beilstein:8075141Beilstein
Citations