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Entry
CA00357                                                            

Classification
Carotenoid Name
Mactraxanthin
IUPAC name (3S,5R,6R,3'S,5'R,6'R)-5,6,5',6'-Tetrahydro-beta,beta-carotene-3,5,6,3',5',6'-hexol
Formula
C40H60O6
Molecular Weight 
636.88 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
9
Number of
conjugated multiple bonds 
9
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
7.786
Hydrogen Bond donors
(Lipinski's definition)
6
Hydrogen Bond Acceptors
(Lipinski's definition)
6
LipinskiFailures
2
Complexity of molecule
0.283
Number of heavy atoms
46
TPSA
(Topological Polar Surface Area) 
121.380 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms

References

CAS
86105-69-3
Links to other DB
KNApSAcK: C00022934
MassBank: CA000078

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