input word = C00011376

Metabolite InformationStructural formula
Name 4,8,12-Tris(acetyloxy)-10-[(acetyloxy)methyl]-2,6-dimethyl-2,6,10-dodecatrienal
Formula C23H32O9
Mw 452.20463262
CAS RN 126621-18-9
C_ID C00011376 ,
InChIKey CPTQKVROSNDWKU-ZJHBHVIRNA-N
InChICode InChI=1S/C23H32O9/c1-15(9-22(31-19(5)27)11-16(2)13-24)10-23(32-20(6)28)12-21(14-30-18(4)26)7-8-29-17(3)25/h7,10-11,13,22-23H,8-9,12,14H2,1-6H3/b15-10+,16-11+,21-7-/t22-,23+/m1/s1
SMILES C/C(=C\[C@@H](C/C(=C/[C@@H](C/C(=C/COC(=O)C)/COC(=O)C)OC(=O)C)/C)OC(=O)C)/C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArctotheca calendula Ref.
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