input word = C00037752

Metabolite InformationStructural formula
Name Rouyolide B
(+)-Rouyolide B
Formula C25H34O6
Mw 430.23553882
CAS RN 613221-02-6
C_ID C00037752 ,
InChIKey MPNMAUIFXAJHFI-RALPHENPNA-N
InChICode InChI=1S/C25H34O6/c1-8-17(5)22(26)29-19-13-15(3)11-10-12-16(4)14-20-21(19)25(7,24(28)30-20)31-23(27)18(6)9-2/h8-9,12-13,19-21H,10-11,14H2,1-7H3/b15-13+,16-12+,17-8-,18-9-/t19-,20+,21-,25+/m0/s1
SMILES [C@H]12[C@H]([C@H](/C=C(/CC/C=C(/C1)\C)\C)OC(=O)/C(=C\C)/C)[C@@](C(=O)O2)(C)OC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeRouya polygama Coincy Ref.
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OrganismRouya polygama Coincy
ReferenceMuckensturm,Phytochem.,63,(2003),863