input word = C00038285

Metabolite InformationStructural formula
Name 5,8-Epoxy-9-acetoxysinulariolide
(+)-5,8-Epoxy-9-acetoxysinulariolide
Formula C22H32O6
Mw 392.21988875
CAS RN 306966-51-8
C_ID C00038285 ,
InChIKey SBHQTFJDBYTNNZ-SZYUJSIKNA-N
InChICode InChI=1S/C22H32O6/c1-13-15-6-9-21(4,28-19(13)24)17-8-11-20(3,26-17)16(25-14(2)23)7-10-22(5)18(12-15)27-22/h15-18H,1,6-12H2,2-5H3/t15-,16+,17+,18+,20-,21-,22-/m1/s1
SMILES [C@H]12CC[C@@]([C@H](CC[C@@]3([C@H](C[C@H]4CC[C@]1(OC(=O)C4=C)C)O3)C)OC(=O)C)(C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sinularia flexibilis Ref.
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OrganismSinularia flexibilis
ReferenceWen,J.Nat.Prod.,71,(2008),1133