input word = C00032914

Metabolite InformationStructural formula
Name Dracunculifoside A
(-)-Dracunculifoside A
Formula C28H40O11
Mw 552.25706212
CAS RN 388077-44-9
C_ID C00032914 ,
InChIKey LQWNOQMNKZOHBE-AWJOWEFKNA-N
InChICode InChI=1S/C28H40O11/c1-15-11-18(29)13-27(3,4)28(15,36)10-9-16(2)38-26-25(35)24(34)23(33)21(39-26)14-37-22(32)8-6-17-5-7-19(30)20(31)12-17/h5-10,12,15-16,18,21,23-26,29-31,33-36H,11,13-14H2,1-4H3/b8-6+,10-9+/t15-,16-,18+,21-,23-,24+,25-,26-,28-/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1COC(=O)/C=C/c1cc(c(cc1)O)O)O[C@@H](/C=C/[C@@]1(C(C[C@H](C[C@H]1C)O)(C)C)O)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis dracunculifolia DC. Ref.
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OrganismBaccharis dracunculifolia DC.
ReferenceNagatani,Chem.Pharm.Bull.,49,(2001),1388