input word = C00022975

Metabolite InformationStructural formula
Name 2,3-Didehydro-3-hydroxy-beta,beta-caroten-4-one
Formula C40H52O2
Mw 564.3967309
CAS RN 6399-46-8
C_ID C00022975 ,
InChIKey RGAZJYSRPZSBTF-GVVOHZSFSA-N
InChICode InChI=1S/C40H52O2/c1-29(18-13-20-31(3)23-25-35-33(5)22-15-27-39(35,7)8)16-11-12-17-30(2)19-14-21-32(4)24-26-36-34(6)38(42)37(41)28-40(36,9)10/h11-14,16-21,23-26,28,41H,15,22,27H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,29-16+,30-17+,31-20+,32-21+
SMILES CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)C(O)=CC2(C)C)C(C)(C)CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaTetranychidaeOligonychus bessardi Ref.
AnimaliaTetranychidaeTetranychus cinnabarinus Ref.
PlantaeRanunculaceaeAdonis annua Ref.
--Schizonobia sycophanta Ref.
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