input word = C00057638

Metabolite InformationStructural formula
Name 3-(Methylthio)-1-hexanol
Formula C7H16OS
Mw 148.09218586
CAS RN 90180-89-5
C_ID C00057638
InChIKey JSASXSHMJYRPCM-UHFFFAOYSA-N
InChICode InChI=1S/C7H16OS/c1-3-4-7(9-2)5-6-8/h7-8H,3-6H2,1-2H3/t7-/m1/s1
SMILES CCC[C@H](CCO)SC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePassifloraceaePassiflora edulis f. flavicarpa Ref.
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OrganismPassiflora edulis f. flavicarpa
ReferenceAldrich Library of 13C and 1H FT NMR Spectra,1992, 1, 442C (nmr)