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Entry
CA01232                                                            

Classification
Carotenoid Name
3-Methoxy-3'-hydroxyleprotene;
3-Methoxy-isorenieratene-3'-ol
IUPAC name 3-Methoxyl-phi,phi-Caroten-3'-ol
Formula
C41H50O2
Molecular Weight 
574.81 g/mol
Structure      Search similar carotenoids

Mol file
Carotenoid DB Fingerprints 
Biological functions/Properties 
Number of
conjugated double bonds 
15
Number of
conjugated multiple bonds 
15
Isomers 
InChI

InChIKey

Canonical SMILES

XLogP
13.765
Hydrogen Bond donors
(Lipinski's definition)
1
Hydrogen Bond Acceptors
(Lipinski's definition)
2
LipinskiFailures
2
Complexity of molecule
0.323
Number of heavy atoms
43
TPSA
(Topological Polar Surface Area) 
29.460 Å2
Reaction
Pathway
Major carotenoid information

Minor carotenoid information

Source organisms
Streptomyces argillaceus (Ref.771) - Actinobacteria (Actinobacteria - Streptomycetaceae)
References
  • Ref.771: Adriana Becerril et al., PLOS ONE | https://doi.org/10.1371/journal.pone.0198145 May 24, 2018, “Uncovering production of specialized metabolites by Streptomyces argillaceus: Activation of cryptic biosynthesis gene clusters using nutritional and genetic approaches”.
  • CAS

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