precursor

Showing entry for Lycopene (tetra-cis)

Identification

PhytoHub ID
PHUB000460
Name
Lycopene (tetra-cis)
Synonyms
  • Prolycopene
CAS Number
Not Available
Average Mass
536.8726
Monoisotopic Mass
536.438201792
Chemical Formula
C40H56
IUPAC Name
prolycopene
InChI Key
OAIJSZIZWZSQBC-BYUNHUQQSA-N
InChI Identifier
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-
SMILES
CC(C)=CCC\C(C)=C\C=C/C(/C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(\C)/C=C\C=C(/C)CCC=C(C)C
Structure
MOLSDFPDBSMILESInChI

Calculated Properties

Solubility (ALOGPS)
3.97e-04 g/l
LogS (ALOGPS)
-6.13
LogP (ALOGPS)
9.16
Hydrogen Acceptors
0
Hydrogen Donors
0
Rotatable Bond Count
16
Polar Surface Area
0
Refractivity
197.80600000000007
Polarizability
70.418361934838
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
Not Available
pKa (strongest acidic)
Not Available
FreewebChemaxon powered

Taxonomy

Family
Terpenoids
Class
Carotenoids
Sub-class
Not Available

Spectra

No spectra information available

Food Sources

No food source information available

Metabolism

No metabolism information available

Back