input word = C00033555

Metabolite InformationStructural formula
Name 2-Methyl-1,3-butanediol
Formula C5H12O2
Mw 104.08372963
CAS RN 684-84-4
C_ID C00033555 ,
InChIKey GNBPEYCZELNJMS-UHFFFAOYNA-N
InChICode InChI=1S/C5H12O2/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3/t4-,5+/m0/s1
SMILES C[C@H]([C@H](CO)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSapotaceaeSebertia acuminata Ref.
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OrganismSebertia acuminata
ReferenceCallahan,Phytochem.,69,(2008),240