input word = C00022885

Metabolite InformationStructural formula
Name Tunaxanthin B
(3R,3'S,6S,6'S)-epsilon,epsilon-Carotene-3,3'-diol
Formula C40H56O2
Mw 568.42803103
CAS RN 72274-50-1
C_ID C00022885 ,
InChIKey BIPAHAFBQLWRMC-SGKLQZFYNA-N
InChICode InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26,35-38,41-42H,27-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36+,37-,38-/m1/s1
SMILES C1[C@H](C=C([C@H](C1(C)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)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaCarangidaeSeriola quinqueradiata Ref.
AnimaliaCoryphaenidaeCoryphaena hippurus Ref.
AnimaliaLabridaeOxyjulis californica Ref.
AnimaliaMonacanthidaeAmanses modestus Ref.
AnimaliaPercichthyidaeSiniperca scherzeri Ref.
AnimaliaScombridaeThunnus thynnus Ref.
PlantaeCyprinidaeCyprinus carpio Ref.
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