input word = C00053462

Metabolite InformationStructural formula
Name Marneral
Formula C30H50O
Mw 426.38616622
CAS RN 883718-04-5
C_ID C00053462
InChIKey VNBRFEUEYRHQBM-OPEBEUCHSA-N
InChICode InChI=1S/C30H50O/c1-23(2)13-9-14-25(5)15-10-16-26(6)17-11-21-30(8)27(7)19-20-28(24(3)4)29(30)18-12-22-31/h13,15,17,22,27,29H,9-12,14,16,18-21H2,1-8H3/b25-15+,26-17+/t27-,29-,30-/m1/s1
SMILES C/C(C)=C1CC[C@@H](C)[C@](CC/C=C(C)/CC/C=C(C)/CC/C=C(C)/C)(C)[C@@H]/1CCC=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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