input word = C00058246

Metabolite InformationStructural formula
Name Stigmast-22-ene-3,6-dione
Formula C29H46O2
Mw 426.34978071
CAS RN 88661-99-8
C_ID C00058246
InChIKey FJQGCLCMDPGZHC-YREUODSCSA-N
InChICode InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h8-9,18-20,22-26H,7,10-17H2,1-6H3/b9-8+/t19-,20-,22+,23-,24+,25+,26-,28-,29-/m1/s1
SMILES CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC(=O)[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePalmaePhoenix dactylifera Ref.
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