CHEBI:23057 - cathasterone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cathasterone
ChEBI ID CHEBI:23057
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H48O3
Net Charge 0
Average Mass 432.67892
Monoisotopic Mass 432.36035
InChI InChI=1S/C28H48O3/c1-16(2)17(3)13-25(30)18(4)21-7-8-22-20-15-26(31)24-14-19(29)9-11-28(24,6)23(20)10-12-27(21,22)5/h16-25,29-30H,7-15H2,1-6H3/t17-,18+,19+,20+,21-,22+,23+,24-,25+,27-,28-/m1/s1
InChIKey JSVPGVHCEQDJCZ-VGEHDTSWSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC(=O)[C@@]4([H])C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)[C@@H](O)C[C@@H](C)C(C)C
ChEBI Ontology
Outgoing cathasterone (CHEBI:23057) is a 22-hydroxy steroid (CHEBI:36863)
cathasterone (CHEBI:23057) is a 3β-hydroxy steroid (CHEBI:36836)
cathasterone (CHEBI:23057) is a 6-oxo steroid (CHEBI:36883)
cathasterone (CHEBI:23057) is a phytosteroid (CHEBI:26124)
Incoming 6-deoxycathasterone (CHEBI:20714) has functional parent cathasterone (CHEBI:23057)
IUPAC Name
(22S)-3β,22-dihydroxy-5α-campestan-6-one
Synonym Source
6-oxo-campestan-3β,22R-diol LIPID MAPS
Manual Xrefs Databases
C00007275 KNApSAcK
C15790 KEGG COMPOUND
LMST01030132 LIPID MAPS
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Registry Number Type Source
7416517 Beilstein Registry Number Beilstein
Last Modified
04 August 2014