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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1293
CHEMBL1293
Compound Name BETA CAROTENE
ChEMBL Synonyms BetaVit | Solatene | Beta-carotene | Betacarotene | Lucaratin
Max Phase 4 (Approved)
Trade Names BetaVit | Solatene | Lucaratin
Molecular Formula C40H56

Additional synonyms for CHEMBL1293 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C\C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)\C=C\C=C ...
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Standard InChI InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-3 ...
Download InChI
Standard InChI Key OENHQHLEOONYIE-JLTXGRSLSA-N

Molecule Features

CHEMBL1293 compound icon
Drug Type:Natural Product Rule of Five:N First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Y Parenteral:N Topical:N Black Box:N Availability Type:Discontinued

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 7 structural alerts for CHEMBL1293. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL1293

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
536.9 536.4382 12 10 0 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
0 0 2 0 0 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 14.76 14.76 0 40 0.24

Compound Cross References

ATC D - DERMATOLOGICALS
D02 - EMOLLIENTS AND PROTECTIVES
D02B - PROTECTIVES AGAINST UV-RADIATION
D02BB - Protectives against UV-radiation for systemic use
D02BB01 - betacarotene

A - ALIMENTARY TRACT AND METABOLISM
A11 - VITAMINS
A11C - VITAMIN A AND D, INCL. COMBINATIONS OF THE TWO
A11CA - Vitamin A, plain
A11CA02 - betacarotene

ChemSpider ChemSpider:OENHQHLEOONYIE-JLTXGRSLSA-N
DailyMed beta carotene
PubChem SID: 144205110 SID: 26750098 SID: 47193664 SID: 87219208
Wikipedia Beta-Carotene

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1293



BindingDB 54988
ChEBI 17579
eMolecules 17497505
FDA SRS 01YAE03M7J
Human Metabolome Database HMDB00561
MolPort MolPort-001-785-959
Nikkaji J617.461B J648.552I J3.095C J889.196F
PDBe BCR
PubChem 5280489
PubChem: Thomson Pharma 14910192
Recon caro
Selleck Beta-Carotene
SureChEMBL SCHEMBL6151
ZINC ZINC06845076

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