CHEBI:18533 - 5α-campestan-3-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5α-campestan-3-one
ChEBI ID CHEBI:18533
ChEBI ASCII Name 5alpha-campestan-3-one
Definition A brassinosteroid that is 5α-campestane bearing an oxo substituent at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C28H48O
Net Charge 0
Average Mass 400.68012
Monoisotopic Mass 400.37052
InChI InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h18-21,23-26H,7-17H2,1-6H3/t19-,20-,21+,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey DDJMOMHMVFXEQF-JBQSTXLYSA-N
SMILES [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@@]34[H])[C@H](C)CC[C@@H](C)C(C)C)[C@@]1(C)CCC(=O)C2
Metabolite of Species Details
Pisum sativum (NCBI:txid3888) See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5α-campestan-3-one (CHEBI:18533) has parent hydride 5α-campestane (CHEBI:20640)
5α-campestan-3-one (CHEBI:18533) has role plant metabolite (CHEBI:76924)
5α-campestan-3-one (CHEBI:18533) is a 3-oxo-5α-steroid (CHEBI:13601)
5α-campestan-3-one (CHEBI:18533) is a brassinosteroid (CHEBI:22921)
5α-campestan-3-one (CHEBI:18533) is a C28-steroid (CHEBI:188921)
IUPAC Name
5α-campestan-3-one
Synonyms Sources
(24R)-24-methyl-5α-cholestan-3-one ChEBI
(24R)-5α-ergostan-3-one IUPAC
(24R)-5alpha-Ergostan-3-one KEGG COMPOUND
3-Dehydro-campestanol HMDB
5α-campestan-3-one UniProt
5alpha-Campestan-3-one KEGG COMPOUND
Campestan-3-one LIPID MAPS
Methylcholestanone HMDB
Manual Xrefs Databases
C15786 KEGG COMPOUND
CPD-709 MetaCyc
HMDB0012116 HMDB
LMST01030123 LIPID MAPS
View more database links
Registry Numbers Types Sources
10732169 Beilstein Registry Number Beilstein
10732169 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
15286289 PubMed citation Europe PMC
Last Modified
14 August 2017