Phyto4Health

Lycopene

Representations & DB's id

ChEBI: CHEBI:15948
ChEMBL: CHEMBL501174
PubChem: 446925
IUPAC: (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene
Standard InChI: InChI=1S/C40H56/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-22,25-32H,13-14,23-24H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,32-18+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
Standard InChI Key: OAIJSZIZWZSQBC-GYZMGTAESA-N
SMILES: C/C(=CC=CC=C(C=CC=C(C=CC=C(CCC=C(C)C)/C)/C)/C)/C=C/C=C(/C=C/C=C(/CCC=C(C)C)C)C

Molecular propeties

AlogP: 12.94
Hydrogen bonds acceptors: 0
Hydrogen bonds donors: 0
Rotatable bonds: 16
Number of rings: 0
Molecular Weight: 536.44
Topological polar surface area: 0
Number of aromatic rings: 0
Fsp3: 0.35
Number of carbons: 40

Plant sources

Part of plant Plant name Ref.
FruitVitis vinifera
PlantPrunus laurocerasus
PlantSalvia officinalis

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency11220.2 nMPrelamin-A/CP02545
Potency19952.6 nMHistone-lysine N-methyltransferase, H3 lysine-9 specific 3Q96KQ7
Potency33498.3 nMGemininO75496
Potency18837.5 nMGemininO75496