input word = C00050873

Metabolite InformationStructural formula
Name Isobaimonidine
Formula C27H45NO3
Mw 431.33994431
CAS RN 74184-79-5
C_ID C00050873
InChIKey IUKLSMSEHKDIIP-ATLHLMKGNA-N
InChICode InChI=1S/C27H45NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-25,29-31H,4-14H2,1-3H3/t15-,16+,17+,18+,19-,20-,21-,22-,23+,24-,25-,26+,27-/m0/s1
SMILES C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](C[C@H](O)[C@H]5C[C@H](O)CC[C@@]54C)[C@@H]3CC[C@@H]1[C@]2(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeFritillaria imperialis Ref.
PlantaeLiliaceaeFritillaria verticillata var.thunbergii Ref.
zoom in