input word = C00056516

Metabolite InformationStructural formula
Name Garcinenone E
Formula C28H34O7
Mw 482.23045344
CAS RN 1151768-02-3
C_ID C00056516
InChIKey SZLLDCVUBZGNNI-UHFFFAOYSA-N
InChICode InChI=1S/C28H34O7/c1-14(2)7-9-17-16(11-12-28(5,6)34)21-24(32)22-20(30)13-19(29)18(10-8-15(3)4)26(22)35-27(21)25(33)23(17)31/h7-8,13,29-31,33-34H,9-12H2,1-6H3
SMILES OC1=C2C(C(C(C(O)=CC(O)=C3C/C=C(C)/C)=C3O2)=O)=C(C(C/C=C(C)/C)=C1O)CCC(C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia xanthochymus Ref.
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OrganismGarcinia xanthochymus
ReferenceZhong, F.F. et al., Chin. J. Chem., 2009, 27, 74-80 (Garcinenone E)