input word = C00027992

Metabolite InformationStructural formula
Name Buxaminol C
Formula C27H46N2O
Mw 414.3610141
CAS RN 191288-32-1
C_ID C00027992 ,
InChIKey UFOMWAWIEKKLJS-SEHMNSCGNA-N
InChICode InChI=1S/C27H46N2O/c1-17(29(7)8)24-22(30)16-27(5)21-11-10-20-18(9-12-23(28-6)25(20,2)3)15-19(21)13-14-26(24,27)4/h13,15,17,20-24,28,30H,9-12,14,16H2,1-8H3/t17-,20+,21+,22+,23-,24-,26+,27-/m0/s1
SMILES CN[C@H]1CCC2=CC3=CC[C@]4(C)[C@@H]([C@H](C)N(C)C)[C@H](O)C[C@@]4(C)[C@@H]3CC[C@H]2C1(C)C
Start Substs in Alk. Biosynthesis (Prediction) Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeBuxus sempevirens (L.) Ref.
zoom in