input word = C00053280

Metabolite InformationStructural formula
Name Guajadial F
Formula C30H34O5
Mw 474.2406242
CAS RN 1529775-08-3
C_ID C00053280
InChIKey DOFRMKNDUPWODG-BTAFNHGTSA-N
InChICode InChI=1S/C30H34O5/c1-16(2)19-11-10-17(3)20-12-24-25(18-8-6-5-7-9-18)26-28(34)22(14-31)27(33)23(15-32)29(26)35-30(24,4)13-21(19)20/h5-9,13-17,19-20,24-25,33-34H,10-12H2,1-4H3/t17-,19+,20-,24-,25+,30-/m1/s1
SMILES CC(C)[C@@H]1CC[C@@H](C)[C@H]2C[C@@H]3[C@H](c4ccccc4)c4c(O)c(C=O)c(O)c(C=O)c4O[C@]3(C)C=C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaePsidium guajava Ref.
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