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CHEBI:748501 - lexacalcitol

Default Structure
ChEBI IDCHEBI:748501
ChEBI Namelexacalcitol
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H48O4
Net Charge0
Average Mass460.699
Monoisotopic Mass460.35526
SMILES[H][C@@]12CC[C@]([H])([C@@H](C)OCCCC(O)(CC)CC)[C@@]1(C)CCC/C2=C\C=C1\C[C@@H](O)C[C@H](O)C1=C
InChIInChI=1S/C29H48O4/c1-6-29(32,7-2)16-9-17-33-21(4)25-13-14-26-22(10-8-15-28(25,26)5)11-12-23-18-24(30)19-27(31)20(23)3/h11-12,21,24-27,30-32H,3,6-10,13-19H2,1-2,4-5H3/b22-11+,23-12-/t21-,24-,25-,26+,27+,28-/m1/s1
InChIKeyKLZOTDOJMRMLDX-YBBVPDDNSA-N
Roles Classification
Biological Role:
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
ChEBI Ontology
Outgoing Relation(s)
lexacalcitol (CHEBI:748501) is a vitamin D (CHEBI:27300)
INN  Source
lexacalcitolWHO MedNet
Synonyms  Source
KH-106ChEMBL
KH106ChEMBL
KH-1060ChEMBL
KH1060ChEMBL
Citations