precursor
Showing entry for Lycopene
Identification
- PhytoHub ID
- PHUB000363
- Name
- Lycopene
- Synonyms
- all-trans lycopene
- CAS Number
- Not Available
- Average Mass
- 536.888
- Monoisotopic Mass
- 536.438201803
- Chemical Formula
- C40H56
- IUPAC Name
- lycopene
- InChI Key
- OAIJSZIZWZSQBC-GYZMGTAESA-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
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
- 0.0
- Refractivity
- 197.80600000000007
- Polarizability
- 72.50914158500643
- Formal Charge
- 0
- Physiological Charge
- 0
- pKa (strongest basic)
- Not Available
- pKa (strongest acidic)
- Not Available
External Links
- ChEBI
- 15948
- ChEBI
- 62466
- PubChem
- 446925
- Chemistry Dashboard
- DTXSID2046593
- KNApSAcK
- C00000911
- MetaboLights
- MTBLC15948
- Exposome Explorer
- 86
Taxonomy
- Family
- Terpenoids
- Class
- Carotenoids
- Sub-class
- Not Available
Spectra
No spectra information available
Food Sources
Name | Group | |||
---|---|---|---|---|
Cherry tomato | Vegetables, Fruit vegetables | Publications | Show | |
Fig | Fruit, Other fruits | Publications | Show | |
Guava | Fruit, Tropical fruits | Publications | Show | |
Ketchup | Condiments and seasonings | Publications | Show | |
Mango | Fruit, Tropical fruits | Publications | Show | |
Papaya | Fruit, Tropical fruits | Publications | Show | |
Persimmon | Herbs and Spices | Publications | Show | |
Pineapple | Fruit, Tropical fruits | Publications | Show | |
Pumpkin | Vegetables, Gourds | Publications | Show | |
Tomato | Vegetables, Fruit vegetables | Publications | Show | |
Watermelon | Vegetables, Gourds | Publications | Show |
Metabolism
No metabolism information available