input word = C00042537

Metabolite InformationStructural formula
Name Garcinielliptone FB
Formula C38H50O7
Mw 618.35565395
CAS RN 863311-83-5
C_ID C00042537 ,
InChIKey VFFHZZBYMYASGN-RYNLPUNGNA-N
InChICode InChI=1S/C38H50O7/c1-21(2)11-12-24(23(5)6)17-26-20-37(16-15-22(3)4)33-27(19-30(45-33)36(9,10)44)32(42)38(34(37)43,35(26,7)8)31(41)25-13-14-28(39)29(40)18-25/h13-15,18,24,26,30,39-40,44H,1,5,11-12,16-17,19-20H2,2-4,6-10H3/t24-,26+,30+,37-,38+/m0/s1
SMILES C1([C@@H](C[C@]2(C3=C(C(=O)[C@]1(C(=O)c1ccc(c(c1)O)O)C2=O)C[C@@H](O3)C(C)(C)O)CC=C(C)C)C[C@@H](C(=C)C)CCC(=C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia subelliptica Ref.
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OrganismGarcinia subelliptica
ReferenceWu,J.Nat.Prod.,68,(2005),1125