input word = C00022993

Metabolite InformationStructural formula
Name 1',2'-Dihydro-1'-hydroxy-beta,psi-caroten-4-one
Formula C40H56O2
Mw 568.42803103
CAS RN 26056-68-8
C_ID C00022993 ,
InChIKey OTHIIUCTNIRKIT-XWJYYVJYSA-N
InChICode InChI=1S/C40H56O2/c1-31(19-13-21-33(3)22-14-23-34(4)25-16-29-40(9,10)42)17-11-12-18-32(2)20-15-24-35(5)26-27-37-36(6)38(41)28-30-39(37,7)8/h11-15,17-24,26-27,42H,16,25,28-30H2,1-10H3/b12-11+,19-13+,20-15+,22-14+,27-26+,31-17+,32-18+,33-21+,34-23+,35-24+
SMILES C1CC(=O)C(=C(C1(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCCC(O)(C)C)\C)\C)\C)/C)/C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaMycobacteriaceaeMycobacterium phlei str. Vera Ref.
BacteriaMyxoccaceaeMyxococcus fulvus str. MXf2 Ref.
BacteriaNocardiaceaeRhodococcus rhodochrous RNMS1 Ref.
--Stigmatella aurantiaca Ref.
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