input word = C00034168

Metabolite InformationStructural formula
Name Pregnacetal
Formula C23H38O5
Mw 394.27192432
CAS RN 1095035-54-3
C_ID C00034168 ,
InChIKey KYGPNWVAMZIKIS-JDYIBBLLNA-N
InChICode InChI=1S/C23H38O5/c1-14(24)23(26)19(25)12-18-16-7-6-15-13-22(27-4,28-5)11-10-20(15,2)17(16)8-9-21(18,23)3/h14-18,24,26H,6-13H2,1-5H3/t14-,15+,16-,17+,18+,20+,21+,23-/m1/s1
SMILES COC1(OC)CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC(=O)[C@]2(O)[C@@H](C)O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAglaia silvestris Ref.
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