input word = C00040036

Metabolite InformationStructural formula
Name Plagiochiline U
Formula C20H26O7
Mw 378.16785319
CAS RN 245106-83-6
C_ID C00040036 ,
InChIKey WGGIEUHNKMVGPD-SFHPTKDNNA-N
InChICode InChI=1S/C20H26O7/c1-10-6-7-14-17(20(14,4)19(23)24-5)16-13(8-25-11(2)21)9-26-18(15(10)16)27-12(3)22/h9,14-18H,1,6-8H2,2-5H3/t14-,15-,16-,17-,18+,20+/m0/s1
SMILES C=C1CC[C@H]2[C@@H]([C@H]3C(COC(C)=O)=CO[C@H](OC(C)=O)[C@@H]13)[C@]2(C)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlagiochilaceaePlagiochila carringtonii Ref.
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