CHEBI:18364 - 14-demethyllanosterol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 14-demethyllanosterol
ChEBI ID CHEBI:18364
Definition A 3β-sterol formed formally by loss of a methyl group from the 14-position of lanosterol.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:755, CHEBI:11921, CHEBI:19151
Supplier Information ChemicalBook:CB2459598, eMolecules:2727012, ZINC000019875504
Download Molfile XML SDF
more structures >>
Formulae C29H48O
C29H48O
Net Charge 0
Average Mass 412.702
Monoisotopic Mass 412.37052
InChI InChI=1S/C29H48O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h9,20,22-23,25-26,30H,8,10-18H2,1-7H3/t20-,22-,23+,25+,26+,28-,29-/m1/s1
InChIKey CHGIKSSZNBCNDW-QGBOJXOESA-N
SMILES C12=C([C@]3([C@]([C@](CC3)([C@@H](CCC=C(C)C)C)[H])(C)CC1)[H])CC[C@@]4([C@@]2(CC[C@@H](C4(C)C)O)C)[H]
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 14-demethyllanosterol (CHEBI:18364) has functional parent lanosterol (CHEBI:16521)
14-demethyllanosterol (CHEBI:18364) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
14-demethyllanosterol (CHEBI:18364) has role human metabolite (CHEBI:77746)
14-demethyllanosterol (CHEBI:18364) has role mouse metabolite (CHEBI:75771)
14-demethyllanosterol (CHEBI:18364) is a 3β-sterol (CHEBI:35348)
Incoming 4β-hydroxymethyl-4α-methyl-5α-cholesta-8,24-dien-3β-ol (CHEBI:143572) has functional parent 14-demethyllanosterol (CHEBI:18364)
IUPAC Name
4,4-dimethyl-5α-cholesta-8,24-dien-3β-ol
Synonyms Sources
(3β,5α)-4,4-dimethylcholesta-8,24-dien-3-ol ChemIDplus
14-Demethyllanosterol KEGG COMPOUND
14-desmethyllanosterol ChEBI
4,4-Dimethyl-5alpha-cholesta-8,24-dien-3beta-ol KEGG COMPOUND
4,4-dimethyl-5α-cholesta-8,24-dien-3β-ol UniProt
4,4-Dimethyl-8,24-cholestadienol KEGG COMPOUND
4,4-dimethylcholesta-8(9),24-dien-3β-ol ChEBI
4,4-dimethylzymosterol ChemIDplus
Manual Xrefs Databases
C00023776 KNApSAcK
C05108 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
2302110 Reaxys Registry Number Reaxys
7448-02-4 CAS Registry Number KEGG COMPOUND
7448-02-4 CAS Registry Number ChemIDplus
Last Modified
13 November 2019