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Entry
CA00517                                                            

Classification
Carotenoid Name
19'-Hydroxyfucoxanthinol
IUPAC name (3S,5R,6S,3'S,5'R,6'R)-5,6-Epoxy-3,3',5',19'-tetrahydroxy-6',7'-didehydro-5,6,7,8,5',6'-hexahydro-beta,beta-caroten-8-one
Formula
C40H56O6
Molecular Weight 
632.848 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
9 including one ketone (9 in total)
Number of
conjugated multiple bonds 
9 including one ketone (9 in total)
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
7.253
Hydrogen Bond donors
(Lipinski's definition)
4
Hydrogen Bond Acceptors
(Lipinski's definition)
6
LipinskiFailures
2
Complexity of molecule
0.304
Number of heavy atoms
46
TPSA
(Topological Polar Surface Area) 
110.520 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms

References

CAS
179948-56-2
Links to other DB
KNApSAcK: C00023037

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