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Carotenoids DB: CA01131
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Entry
CA01131
Classification
C40 carotenoids including C40 originated apocarotenoids and intermediates
1.1 psi,psi Carotene
 
C40 Hydrocarbons
Carotenoid Name
(9Z)-Lycopene
IUPAC name
(9Z)-psi,psi-Carotene
Formula
C40H56
Molecular Weight
536.848 g/mol
Structure
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9Z
,
psi,psi
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Biological functions/Properties
Non enzymatically isomerized from all-trans-lycopene (Ref.541).
Number of
conjugated double bonds
11
Number of
conjugated multiple bonds
11
Isomers
Cis/trans isomer:
CA00043
,
CA01130
,
CA01132
,
CA00044
Constitutional isomer:
CA00311
InChI
InChIKey
Canonical SMILES
XLogP
14.586
Hydrogen Bond donors
(Lipinski's definition)
0
Hydrogen Bond Acceptors
(Lipinski's definition)
0
LipinskiFailures
2
Complexity of molecule
0.000
Number of heavy atoms
40
TPSA
(Topological Polar Surface Area)
0.000 Å
2
Reaction
Substrate:
CR00372
Product:
CR00362
Pathway
Major carotenoid information
Minor carotenoid information
Source organisms
References
Ref.541: Jürgen Breitenbach, Gerhard Sandmann, Planta, March 2005, Volume 220, Issue 5, pp 785-793, "ζ-Carotene cis isomers as products and substrates in the plant poly-cis carotenoid biosynthetic pathway to lycopene".
CAS
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