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Carotenoids DB          Carotenoids DB: CA01041   
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Entry
CA01041                                                            
Classification
Carotenoid Name
(all-E)-Retinoyl-β-glucuronide;
Retinoic aicd, 1-ester with β-D-glucopyranosiduronic acid;
Retinoic aicd, 1-ester with beta-D-glucopyranosiduronic acid;
all-trans-Retinoyl-beta-glucuronide;
Retinoyl glucuronide;
β-D-Glucopyranuronic acid, 1-retinoate
IUPAC name 15-Apo-15-beta-D-glucuronosyl-beta-caroten-15-oic acid
Formula
C26H36O8
Molecular Weight 
476.548 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
6 including one carboxylic acid glucuronide (6 in total)
Number of
conjugated multiple bonds 
6 including one carboxylic acid glucuronide (6 in total)
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
5.105
Hydrogen Bond donors
(Lipinski's definition)
4
Hydrogen Bond Acceptors
(Lipinski's definition)
8
LipinskiFailures
1
Complexity of molecule
0.314
Number of heavy atoms
34
TPSA
(Topological Polar Surface Area) 
133.520 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms

References

CAS
401-10-5
Links to other DB

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