input word = C00023008

Metabolite InformationStructural formula
Name 2,3-Dihydroxy-beta,psi-caroten-4-one
Formula C40H54O3
Mw 582.40729559
CAS RN 69003-02-7
C_ID C00023008 ,
InChIKey OVFZDLQYLJFCFF-GNZAGARINA-N
InChICode InChI=1S/C40H54O3/c1-29(2)17-13-20-32(5)23-15-25-33(6)24-14-21-30(3)18-11-12-19-31(4)22-16-26-34(7)27-28-36-35(8)37(41)38(42)39(43)40(36,9)10/h11-12,14-19,21-28,38-39,42-43H,13,20H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,28-27+,30-18+,31-19+,32-23+,33-24+,34-26+/t38-,39+/m0/s1
SMILES C1(=C(C(=O)[C@@H]([C@H](C1(C)C)O)O)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaRhizobiaceaeRhizobium lupini Ref.
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OrganismRhizobium lupini
ReferenceKleinig,Arch. Microbiol.,119,(1978),71