Carotenoids obi
All carotenoids     All organisms     All pathways     All reactions     Feedback
Carotenoids DB          Carotenoids DB: CA00752   
[   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
CA00752                                                            
Classification
Carotenoid Name
Bastaxanthol b diacetate
IUPAC name 3,19-Bis-ethanoyloxy-7,8-didehydro-3',6'-dioxo-beta,kappa-Carotene-16'-al
Formula
C44H56O7
Molecular Weight 
696.888 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 
11 including one ketone (11 in total)
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
7.705
Hydrogen Bond donors
(Lipinski's definition)
1
Hydrogen Bond Acceptors
(Lipinski's definition)
7
LipinskiFailures
2
Complexity of molecule
0.280
Number of heavy atoms
51
TPSA
(Topological Polar Surface Area) 
106.970 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Ianthella basta (Ref.260) - Sea sponge (Porifera - Ianthellidae)
References
  • Ref.260: Hertzberg, Sissel; Johansen, Jon E.; Ramdahl, Thomas; Borch, Gunner; Liaaen-Jensen, Synnoeve, Biochemical Systematics and Ecology (1983), 11(3), 267-75. "Carotenoid sulfates. Part 3. Minor carotenoid sulfates from Ianthella basta".
    • CAS
    88930-56-7
    Links to other DB

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