Accession Number: pdtdbl00007

Details of the Ligand

Ligand Name : beta-Carotene 5,6-Epoxide
Systematic Names : beta-Carotene 5,6-Epoxide; 5,6-epoxy-beta,beta-Carotene
Molecular Formula : C40H56O
Molecular Weight : g/mol
IUPAC Name : 1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-7-oxabicyclo[4.1.0]heptane
Canonical SMILES : CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC23C(CCCC2(O3)C)(C)C)C)C
Ligand Description :
5,6-epoxy-beta-Carotene was much more active than β-Carotene in the induction of differentiation of NB4 cells.
Related Plants :
Papaya
Ligand Related Dockings :
NA
Ligand References :
  1. http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:27793
  2. https://pubchem.ncbi.nlm.nih.gov/compound/5281231
  3. http://www.chemspider.com/Chemical-Structure.4444643.html
  4. http://kanaya.naist.jp/knapsack_jsp/information.jsp?sname=C_ID&word=C00003767
beta-Carotene 5,6-Epoxide

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