Carotenoids obi
All carotenoids     All organisms     All pathways     All reactions     Feedback
Carotenoids DB          Carotenoids DB: CA00101   
[   About  |   Help  |   Search carotenoid entry  |   Search organism entry  |   Search similar carotenoids  |   Predict biological activities of this carotenoid  |   Search possible biosynthetic routes of this carotenoid   ]
Entry
CA00101                                                            
Classification
Carotenoid Name
3,4-Dehydrorhodopin glucoside
IUPAC name 1-beta-D-Glucopyranosyloxy-3,4-didehydro-1,2-dihydro-psi,psi-carotene
Formula
C46H66O6
Molecular Weight 
714.988 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
12
Number of
conjugated multiple bonds 
12
Isomers 
  • Constitutional isomer: CA01058, CA00239, CA00214, CA00360, CA00361
    • InChI

    InChIKey

    Canonical SMILES

    XLogP
    12.256
    Hydrogen Bond donors
    (Lipinski's definition)
    4
    Hydrogen Bond Acceptors
    (Lipinski's definition)
    6
    LipinskiFailures
    2
    Complexity of molecule
    0.051
    Number of heavy atoms
    52
    TPSA
    (Topological Polar Surface Area) 
    99.380 Å2
    Reaction
    Pathway
    Major carotenoid information

    Minor carotenoid information

    Source organisms
    Rhodospirillum rubrum  - Alphaproteobacteria: phototrophic purple non-sulfur bacteria (Alphaproteobacteria - Rhodospirillaceae)
    References

    CAS
    162441-88-5
    Links to other DB
    KNApSAcK: C00022853
    LipidBank: VCA1188

       Searching other references with Google Scholar or searching the colour of this carotenoid by Google image search