Carotenoids obi
All carotenoids     All organisms     All pathways     All reactions     Feedback
Carotenoids DB          Carotenoids DB: CA00613   
[   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
CA00613                                                            

Classification
Carotenoid Name
4-Hydroxy-α-carotene;
4-Hydroxy-alpha-carotene
IUPAC name beta,epsilon-Caroten-4-ol
Formula
C40H56O
Molecular Weight 
552.848 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
10
Number of
conjugated multiple bonds 
10
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
13.157
Hydrogen Bond donors
(Lipinski's definition)
1
Hydrogen Bond Acceptors
(Lipinski's definition)
1
LipinskiFailures
1
Complexity of molecule
0.309
Number of heavy atoms
41
TPSA
(Topological Polar Surface Area) 
20.230 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Loligo vulgaris  - European squid (Mollusca - Loliginidae)
References

CAS
2213-16-3
Links to other DB

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