input word = C00023007

Metabolite InformationStructural formula
Name alpha-Doradexanthin
(3S,3'S,6'R)-3,3'-Dihydroxy-beta,epsilon-caroten-4-one
Formula C40H54O3
Mw 582.40729559
CAS RN 29125-77-7
C_ID C00023007 ,
InChIKey JKMGDISLOMKFOX-DPWCMENMNA-N
InChICode InChI=1S/C40H54O3/c1-28(17-13-19-30(3)21-23-35-32(5)25-34(41)26-39(35,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-36-33(6)38(43)37(42)27-40(36,9)10/h11-25,34-35,37,41-42H,26-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t34-,35+,37+/m1/s1
SMILES C1(=C(C(=O)[C@H](CC1(C)C)O)C)/C=C/C(=C/C=C/C(=C\C=C\C=C(\C=C\C=C(\C=C\[C@@H]1C(C[C@@H](C=C1C)O)(C)C)/C)/C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaCyprinidaeCarassius auratus Ref.
AnimaliaDiogenidaeClibanarius erythropus Ref.
AnimaliaPapilionidaePapilio xuthus Ref.
AnimaliaSparidaePagrus major Ref.
zoom in