input word = C00052147

Metabolite InformationStructural formula
Name 3-Methyl sulfolane
Formula C4H8O2S
Mw 120.02450023
CAS RN 126-33-0
C_ID C00052147
InChIKey HXJUTPCZVOIRIF-UHFFFAOYSA-N
InChICode InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2
SMILES O=S1(=O)CCCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
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