input word = C00039224

Metabolite InformationStructural formula
Name Frajunolide H
(+)-Frajunolide H
Formula C28H35ClO11
Mw 582.18678967
CAS RN 1058643-47-2
C_ID C00039224 ,
InChIKey MBRBCPOVEZYRKS-XZGZDZKLNA-N
InChICode InChI=1S/C28H35ClO11/c1-12-9-10-20(37-16(5)31)27(8)21(13(2)11-19(36-15(4)30)23(27)38-17(6)32)24(39-18(7)33)28(35)14(3)26(34)40-25(28)22(12)29/h9-10,14,19-25,35H,1-2,11H2,3-8H3/b10-9+/t14-,19-,20-,21+,22-,23-,24-,25-,27+,28-/m0/s1
SMILES C=C1C[C@H](OC(C)=O)[C@H](OC(C)=O)[C@]2(C)[C@@H](OC(C)=O)/C=C/C(=C)[C@H](Cl)[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.
zoom in