input word = C00003777

Metabolite InformationStructural formula
Name Lutein 5,6-epoxide
taraxanthin
Lutein epoxide
Formula C40H56O3
Mw 584.42294565
CAS RN 28368-08-3
C_ID C00003777 ,
InChIKey DYUUPIKEWLHQGQ-KNIRGMIANA-N
InChICode InChI=1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-25,34-36,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35-,36-,39+,40-/m0/s1
SMILES [C@]12(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(\C)/C=C/[C@@H]3C(C[C@H](C=C3C)O)(C)C)\C)/C)/C)C(C[C@@H](C[C@@]1(C)O2)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTaraxacum officinale Ref.
PlantaeAsteraceaeTussilago farfara Ref.
PlantaeBalsaminaceaeImpatiens nolitangere Ref.
PlantaeConvolvulaceaeCuscuta australis Ref.
PlantaeConvolvulaceaeIpomoea aquatica Ref.
PlantaePoaceaeOryza sativa Ref.
PlantaeRutaceaeCitrus wilsonii Ref.
PlantaeUrticaceaeUrtica dioica Ref.
--Sohaghnum palustre Ref.
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