input word = C00041634

Metabolite InformationStructural formula
Name Linifolioside
Formula C32H50O11
Mw 610.33531244
CAS RN 102907-15-3
C_ID C00041634 ,
InChIKey KFAKUSFWWBRWEJ-UHFFFAOYNA-N
InChICode InChI=1S/C32H50O11/c1-7-31(5)10-8-17-16(13-31)18(34)12-20-30(3,4)21(9-11-32(17,20)6)42-29-27(25(38)23(36)19(14-33)41-29)43-28-26(39)24(37)22(35)15(2)40-28/h7,13,15,17,19-29,33,35-39H,1,8-12,14H2,2-6H3/t15-,17+,19+,20+,21+,22-,23-,24+,25-,26+,27-,28-,29-,31-,32-/m0/s1
SMILES C1[C@@]2([C@@H](C([C@@H](C1)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)CO)(C)C)CC(=O)C1=C[C@](CC[C@@H]21)(C=C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeLeucas aspera Ref.
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