Entry |
|
Classification |
|
Carotenoid Name
|
6'-Hydroxysiphonaxanthin dodecenoate
|
IUPAC name |
(3R,3'R)-19-(trans-Dodec-2-enoyloxy)-3,3',6'-trihydroxy-7,8-dihydro-beta,epsilon-caroten-8-one
|
Formula |
C52H76O6
|
Molecular Weight |
797.128 g/mol
|
Structure |
Search similar carotenoids
Mol file
|
Carotenoid DB Fingerprints |
Predict biological activities of this carotenoid
(3R,3'R), 7,8+H, 3-OH, 3'-OH, 6'-OH, 8=O, beta,epsilon, 19-Dodecanoyloxy
( Help )
|
Biological functions/Properties |
|
Number of conjugated double bonds |
9 and 2 (11 in total)
|
Number of conjugated multiple bonds |
9 and 2 (11 in total)
|
Isomers |
|
InChI |
|
InChIKey |
|
Canonical SMILES |
|
XLogP |
12.220
|
Hydrogen Bond donors (Lipinski's definition) |
3
|
Hydrogen Bond Acceptors (Lipinski's definition) |
6
|
LipinskiFailures |
2
|
Complexity of molecule |
0.224
|
Number of heavy atoms |
58
|
TPSA (Topological Polar Surface Area) |
104.060 Å2
|
Reaction |
|
Pathway |
|
Major carotenoid information |
|
Minor carotenoid information |
|
Source organisms |
Pyramimonas amylifera (Ref.46) - Green alga: Prasinophyte same as Polyblepharides amylifera (Chlorophyta - Pyramimonadales)
|
References |
Ref.46: E. S. Egeland, R. R. L. Guillard, and S. Liaaen-Jensen, Phytochemistry, Vol. 44, No. 6, pp.1087-1097, 1997, "Additional carotenoid prototype representatices and general chemosystematic evaluation of carotenoids in prasinophyceae (chlorophyta)".
|
CAS |
189073-54-9
|
Links to other DB |
|
|