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Carotenoids DB: CA01168
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Entry
CA01168
Classification
C40 carotenoids including C40 originated apocarotenoids and intermediates
5.2 beta,- apo Carotene
 
Apocarotenoids
Carotenoid Name
Dihydroacrinidiolide;
Dihydroactindiolide;
DHA;
Dihydroactinidiolide
IUPAC name
Formula
C11H16O2
Molecular Weight
180.238 g/mol
Structure
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Mol file
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Biological functions/Properties
Fruity odor of black tea (Ref.668)
Number of
conjugated double bonds
2 including one ketone
Number of
conjugated multiple bonds
2 including one ketone
Isomers
InChI
InChIKey
Canonical SMILES
XLogP
2.193
Hydrogen Bond donors
(Lipinski's definition)
0
Hydrogen Bond Acceptors
(Lipinski's definition)
2
LipinskiFailures
0
Complexity of molecule
0.310
Number of heavy atoms
13
TPSA
(Topological Polar Surface Area)
26.300 Å
2
Reaction
Pathway
Pathway:
CB000126
Major carotenoid information
Minor carotenoid information
Source organisms
References
Ref.668: Chi-Tang Ho, Xin Zheng, and Shiming Li, Food Science and Human Wellness 4 (2015) 9–27, "Tea aroma formation", http://dx.doi.org/10.1016/j.fshw.2015.04.001.
CAS
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