input word = C00052127

Metabolite InformationStructural formula
Name 2-Methylerythritol
Formula C7H13NO3
Mw 159.08954329
CAS RN 52320-67-9
C_ID C00052127
InChIKey HOACIBQKYRHBOW-UHFFFAOYSA-N
InChICode InChI=1S/C7H13NO3/c1-3-5(2)7(11)8-4-6(9)10/h5H,3-4H2,1-2H3,(H,8,11)(H,9,10)
SMILES CCC(C)C(=O)NCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
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