input word = C00043001

Metabolite InformationStructural formula
Name Sinularolide A
(+)-Sinularolide A
Formula C20H30O6
Mw 366.20423869
CAS RN 852469-24-0
C_ID C00043001 ,
InChIKey OZILXJUBBKPMRE-SATHWZDXNA-N
InChICode InChI=1S/C20H30O6/c1-12-6-4-8-13(2)17(23)18-15(14(3)19(24)26-18)10-16(22)20(25,11-21)9-5-7-12/h7-8,15-18,21-23,25H,3-6,9-11H2,1-2H3/b12-7-,13-8+/t15-,16+,17-,18-,20+/m1/s1
SMILES C=C1C(=O)O[C@@H]2[C@@H]1C[C@H](O)[C@@](O)(CO)CC/C=C(/C)CC/C=C(C)[C@H]2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sinularia gibberosa Ref.
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OrganismSinularia gibberosa
ReferenceLi,J.Nat.Prod.,68,(2005),649