input word = C00030568

Metabolite InformationStructural formula
Name Junceol F
Formula C31H44O11
Mw 592.28836225
CAS RN 1092697-28-3
C_ID C00030568 ,
InChIKey QPXTUMRLHBAYSX-KFZAYYFNNA-N
InChICode InChI=1S/C31H44O11/c1-10-15(2)28(35)41-24-14-22(38-19(6)32)17(4)13-25-31(37,18(5)29(36)42-25)27(40-21(8)34)26-16(3)11-12-23(30(24,26)9)39-20(7)33/h13,15,18,22-27,37H,3,10-12,14H2,1-2,4-9H3/b17-13-/t15-,18+,22-,23+,24+,25+,26-,27+,30-,31-/m1/s1
SMILES C=C1CC[C@H](OC(C)=O)[C@]2(C)[C@@H](OC(=O)C(C)CC)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 juncea Ref.
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OrganismJunceella juncea
ReferenceSung,Chem.Pharm.Bull.,56,(2008),1276