input word = C00040103

Metabolite InformationStructural formula
Name Pterokaurane M3
(-)-Pterokaurane M3
Formula C20H34O4
Mw 338.24570957
CAS RN 1008122-34-6
C_ID C00040103 ,
InChIKey COMXNNJQOALRDW-XLUPHWDYNA-N
InChICode InChI=1S/C20H34O4/c1-17(11-21)8-14(23)9-18(2)15(17)5-6-19-7-13(3-4-16(18)19)20(24,10-19)12-22/h13-16,21-24H,3-12H2,1-2H3/t13-,14-,15-,16-,17-,18-,19+,20+/m1/s1
SMILES C[C@]1(CO)C[C@@H](O)C[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(CO)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaePieris multifida Poir. Ref.
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