input word = C00022912

Metabolite InformationStructural formula
Name Deepoxyneoxanthin
(3R,3'R)-6,7-Didehydro-5,6-dihydro-3,3',5-trihydroxy-beta,beta-carotene
Formula C40H56O3
Mw 584.42294565
CAS RN 24730-28-7
C_ID C00022912 ,
InChIKey GRSPARSXNHKGDG-OLATXGEDNA-N
InChICode InChI=1S/C40H56O3/c1-29(17-13-19-31(3)21-23-36-33(5)25-34(41)26-38(36,6)7)15-11-12-16-30(2)18-14-20-32(4)22-24-37-39(8,9)27-35(42)28-40(37,10)43/h11-23,34-35,41-43H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21-,29-15+,30-16+,31-19+,32-20+/t24-,34-,35+,40-/m1/s1
SMILES CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)C=C=C2C(C)(C)C[C@H](O)C[C@@]2(C)O)C(C)(C)C[C@H](O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeAsteraceaeTaraxacum officinale Ref.
PlantaeBalsaminaceaeImpatiens noli-tangere Ref.
PlantaePhrymaceaeMimulus guttatus Ref.
PlantaeSolanaceaeSolanum lycopersicum Ref.
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