CHEBI:66571 - leucisterol

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ChEBI Name leucisterol
ChEBI ID CHEBI:66571
Definition A member of the class of phytosterols that is stigmasta-5,22-diene substituted by hydroxy groups at positions 3 and 20 (the 3β,22E stereoisomer). Isolated from the whole plants of Leucas urticifolia, it exhibits cholinesterase inhibitory activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C29H48O2
Net Charge 0
Average Mass 428.69020
Monoisotopic Mass 428.36543
InChI InChI=1S/C29H48O2/c1-7-20(19(2)3)12-17-29(6,31)26-11-10-24-23-9-8-21-18-22(30)13-15-27(21,4)25(23)14-16-28(24,26)5/h8,12,17,19-20,22-26,30-31H,7,9-11,13-16,18H2,1-6H3/b17-12+/t20-,22+,23+,24+,25+,26+,27+,28+,29+/m1/s1
InChIKey RFCDBEXZIQZKRG-WSCQTVFPSA-N
SMILES [H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@@](C)(O)\C=C\[C@@H](CC)C(C)C
Metabolite of Species Details
Leucas urticifolia (NCBI:txid483843) Found in whole plant (BTO:0001461). See: PubMed
Roles Classification
Biological Role(s): EC 3.1.1.8 (cholinesterase) inhibitor
An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8).
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing leucisterol (CHEBI:66571) has parent hydride stigmastane (CHEBI:26773)
leucisterol (CHEBI:66571) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
leucisterol (CHEBI:66571) has role metabolite (CHEBI:25212)
leucisterol (CHEBI:66571) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
leucisterol (CHEBI:66571) is a 3β-sterol (CHEBI:35348)
leucisterol (CHEBI:66571) is a phytosterols (CHEBI:26125)
leucisterol (CHEBI:66571) is a tertiary alcohol (CHEBI:26878)
IUPAC Name
(3β,22E)-stigmasta-5,22-diene-3,20-diol
Citation Waiting for Citations Type Source
18787788 PubMed citation Europe PMC
Last Modified
25 April 2017