Carotenoids obi
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Carotenoids DB          Carotenoids DB: CA00036   
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Entry
CA00036                                                            

Classification
Carotenoid Name
IUPAC name 4'-(beta-D-Glucopyranosyloxy)-7',8'-dihydro-4,4'-diapo-psi,psi-caroten-4-oic acid
Formula
C36H48O8
Molecular Weight 
608.744 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 
InChI

InChIKey

Canonical SMILES

XLogP
6.498
Hydrogen Bond donors
(Lipinski's definition)
5
Hydrogen Bond Acceptors
(Lipinski's definition)
8
LipinskiFailures
2
Complexity of molecule
0.065
Number of heavy atoms
44
TPSA
(Topological Polar Surface Area) 
136.680 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Staphylococcus aureus 209P  - Firmicutes - Bacilli (Firmicutes - Staphylococcaceae)
References

CAS
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Links to other DB

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