input word = C00023010

Metabolite InformationStructural formula
Name Flexixanthin
(3S)-3',4'-Didehydro-1',2'-dihydro-1',3-dihydroxy-beta,psi-caroten-4-one
Formula C40H54O3
Mw 582.40729559
CAS RN 14685-41-7
C_ID C00023010 ,
InChIKey LLKMUZAISVDKFO-ACIYOUFYNA-N
InChICode InChI=1S/C40H54O3/c1-30(19-13-21-32(3)22-14-23-33(4)25-16-28-40(9,10)43)17-11-12-18-31(2)20-15-24-34(5)26-27-36-35(6)38(42)37(41)29-39(36,7)8/h11-27,37,41,43H,28-29H2,1-10H3/b12-11+,19-13+,20-15+,22-14+,25-16+,27-26+,30-17+,31-18+,32-21+,33-23+,34-24+/t37-/m0/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=C(/C=C/CC(C)(O)C)\C)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaFlexibacteraceaeFlexibacter sp. Ref.
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OrganismFlexibacter sp.
ReferenceAasen,Acta Chem. Scand.,20,(1966),1970