input word = C00057032

Metabolite InformationStructural formula
Name Piperenol A triacetate
Formula C27H26O10
Mw 510.15259705
CAS RN 134476-92-9
C_ID C00057032
InChIKey UGMVPWAZGUPKPL-WSOYEBOPSA-N
InChICode InChI=1S/C27H26O10/c1-16(28)34-22-14-21(15-33-26(31)19-10-6-4-7-11-19)23(35-17(2)29)25(24(22)36-18(3)30)37-27(32)20-12-8-5-9-13-20/h4-14,22-25H,15H2,1-3H3/t22-,23+,24+,25-/m1/s1
SMILES CC(=O)O[C@@H]1C(OC(=O)c2ccccc2)[C@@H](OC(C)=O)C(COC(=O)c2ccccc2)=C[C@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper cubeba Ref.
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