input word = C00053274

Metabolite InformationStructural formula
Name Guadial C
Formula C25H26O5
Mw 406.17802394
CAS RN 1783802-73-2
C_ID C00053274
InChIKey XEXIXWSSHYEEDE-TZCWUCCASA-N
InChICode InChI=1S/C25H26O5/c1-24(2)15-8-9-25(19(24)10-15)11-16(14-6-4-3-5-7-14)20-22(29)17(12-26)21(28)18(13-27)23(20)30-25/h3-7,12-13,15-16,19,28-29H,8-11H2,1-2H3/t15-,16+,19+,25+/m1/s1
SMILES CC1(C)[C@@H]2CC[C@]3(C[C@@H](c4ccccc4)c4c(O)c(C=O)c(O)c(C=O)c4O3)[C@H]1C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaePsidium guajava Ref.
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