input word = C00031932

Metabolite InformationStructural formula
Name Junceellolide D
(-)-Junceellolide D
Formula C28H38O11
Mw 550.24141206
CAS RN 121798-81-0
C_ID C00031932 ,
InChIKey XTGNVOVMNXBAIQ-QTGIQMQXNA-N
InChICode InChI=1S/C28H38O11/c1-13-9-10-21(36-17(5)30)27(8)22(37-18(6)31)12-20(35-16(4)29)14(2)11-23-28(34,15(3)26(33)39-23)25(24(13)27)38-19(7)32/h11,15,20-25,34H,1,9-10,12H2,2-8H3/b14-11-/t15-,20+,21-,22-,23-,24+,25-,27+,28-/m0/s1
SMILES C=C1CC[C@H](OC(C)=O)[C@]2(C)[C@@H](OC(C)=O)C[C@@H](OC(C)=O)/C(C)=C[C@@H]3OC(=O)[C@H](C)C3(O)[C@@H](OC(C)=O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Junceella fragilis Ref.
--Junceella juncea Ref.
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OrganismJunceella juncea
ReferenceQi,Chem.Pharm.Bull.,52,(2004),1476