input word = C00007277

Metabolite InformationStructural formula
Name 6-Deoxocathasterone
Formula C28H50O2
Mw 418.38108084
CAS RN 198416-73-8
C_ID C00007277 ,
InChIKey ZHZKWZJLUNXOSN-UWROBKORNA-N
InChICode InChI=1S/C28H50O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h17-26,29-30H,7-16H2,1-6H3/t18-,19+,20+,21+,22+,23-,24+,25+,26+,27-,28-/m1/s1
SMILES CC(C)[C@H](C)C[C@H](O)[C@@H](C)C1CCC2C3CC[C@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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