input word = C00022316

Metabolite InformationStructural formula
Name 18-Hydroxyaustrochaparol diacetate
Formula C24H34O5
Mw 402.2406242
CAS RN 74635-78-2
C_ID C00022316 ,
InChIKey AJBWVIYXURLTIP-VUIYWFBSNA-N
InChICode InChI=1S/C24H34O5/c1-16-20(8-7-19-9-12-27-14-19)24(5)11-6-10-23(4,15-28-17(2)25)22(24)13-21(16)29-18(3)26/h9,12,14,20-22H,1,6-8,10-11,13,15H2,2-5H3/t20-,21+,22-,23-,24+/m1/s1
SMILES C=C1[C@@H](OC(C)=O)C[C@@H]2[C@@](C)(COC(C)=O)CCC[C@@]2(C)[C@@H]1CCc1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAustroeupatorium chaparense Ref.
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