input word = C00040558

Metabolite InformationStructural formula
Name Trigonochinene D
(-)-Trigonochinene D
Formula C21H26O4
Mw 342.18310932
CAS RN 1053209-97-4
C_ID C00040558 ,
InChIKey OLVDZXLYEJAWNY-ZTHXDYBINA-N
InChICode InChI=1S/C21H26O4/c1-7-14-13(4)16(22)11-17-20(5,9-8-19(23)24-6)15(12(2)3)10-18-21(14,17)25-18/h7,11,15,18H,1-2,8-10H2,3-6H3/t15-,18+,20-,21-/m1/s1
SMILES [C@@H]1(C[C@H]2[C@@]3(C(=CC(=O)C(=C3C=C)C)[C@@]1(CCC(=O)OC)C)O2)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeTrigonostemon chinensis Ref.
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