Structure Database (LMSD)
Common Name
Dihydroxylycopene
Systematic Name
1,2,1',2'-Tetrahydro-psi,psi-carotene-1,1'-diol
Synonyms
- 1,1'-Dihydroxylycopene
3D model of Dihydroxylycopene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
ZYTNXYQYKBORNX-CATRKCNMSA-N
InChi (Click to copy)
InChI=1S/C40H56O2/c1-31(2)27-39(41)29-37(9)25-15-23-35(7)21-13-19-33(5)17-11-12-18-34(6)20-14-22-36(8)24-16-26-38(10)30-40(42)28-32(3)4/h11-28,39-42H,29-30H2,1-10H3/b12-11+,19-13+,20-14+,23-15+,24-16+,33-17+,34-18+,35-21+,36-22+,37-25+,38-26+
SMILES (Click to copy)
C(=C(/C)\CC(O)/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(\C)/CC(O)/C=C(\C)/C
References
Comments
Imported from http://carotenoiddb.jp/
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Cereibacter sphaeroides
(#1063)
Alphaproteobacteria
(#28211)
Purification and biochemical characterization of a hydroxyneurosporene desaturase involved in the biosynthetic pathway of the carotenoid spheroidene in Rhodobacter sphaeroides.,
J Bacteriol, 1997
J Bacteriol, 1997
Pubmed ID:
9393712
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
42
Rings
Aromatic Rings
Rotatable Bonds
16
Van der Waals Molecular Volume
683.82
Topological Polar Surface Area
40.46
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
logP
11.45
Molar Refractivity
189.38
Admin
Created at
17th Nov 2021
Updated at
22nd Nov 2021