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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL520535
CHEMBL520535
Compound Name CAMPESTEROL
ChEMBL Synonyms Campesterol
Max Phase 0
Trade Names
Molecular Formula C28H48O

Additional synonyms for CHEMBL520535 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O) ...
Download SMILES
Standard InChI InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-2 ...
Download InChI
Standard InChI Key SGNBVLSWZMBQTH-PODYLUTMSA-N

Structural Alerts

There are 2 structural alerts for CHEMBL520535. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL520535

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
400.7 400.3705 7.63 5 20.23 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
1 1 1 1 1 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 9.97 9.97 0 29 0.47

Compound Cross References

ChemSpider ChemSpider:SGNBVLSWZMBQTH-PODYLUTMSA-N
Wikipedia Campesterol

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL520535



ACToR 474-60-2
ChEBI 28623
eMolecules 36757272
FDA SRS 5L5O665639
IBM Patent System 3DB993939C4D93C3AC3B0CA01008506F
IBM Patents WO2007102957A2 US20050196360 WO2009117152A1 EP2192910A1 EP1190025B1 US20090311329 EP1893038A1 US20020016317 EP1958522A2 EP1693047A2 EP1465932A1 WO2006062933A2 US20100021589 WO2005032277A1 EP1722656A1 US4614620 US20070212411 US20050196512 WO2010061242A1 US20100016269 EP1424907B1 EP0783514B2 US20080305055 EP1694362A1 US20100234531 US20080085322 US5627289 EP1925284B1 WO2007064724A3 US7645748 US20050271692 US20020176878 WO2003092362A2 US4874742 US20040058908 WO2002064809A2 WO1995001098A2 US20050033027 US20040049510 WO2004111073A2 US7635800 WO2010046079A1 US20090299083 US20050255055 EP1763357A1 US20060063828 US6147235 US5424457 EP1946651A1 US5093502 EP1904020A2 US20090143714 WO2003011172A2 WO2003094891A1 US4551278 US20050091708 US20070010513 EP1541152A1 EP2231195A2 US20050053712 US20090053191 EP0838155A1 US6956125 US20070004609 US6153208 WO2001001933A2 US6387358 EP1640041A2 EP1750654A1 US20090158640 US20100098665 EP0950410A1 US20100330158 US4100026 US6312919 EP0413828B1 EP1773328A1 US20040102355 US20070014739 US20080070291 US6419963 EP1694184B1 WO2000047213A1 US7846905 EP1885694A2 US20090181925 US20070155676 US6497865 US20100239694 WO1999059715A1 WO2007012977A2 EP1708579A1 EP1395124B1 EP0024642A1 EP1349909A1 US20100055190 WO2005049633A1 US20060286668 EP2094230A1 WO2010084240A1
KEGG Ligand C01789
Nikkaji J5.962E
PubChem 173183
PubChem: Drugs of the Future 56310600
PubChem: Thomson Pharma 16380182
SureChEMBL SCHEMBL94161
ZINC ZINC04095721

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/SGNBVLSWZMBQTH-PODYLUTMSA-N spacer
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