input word = C00061861

Metabolite InformationStructural formula
Name beta-Cyclocitric acid
Formula C10H16O2
Mw 168.11502975
CAS RN 471-90-9
C_ID C00061861
InChIKey XOQRKINTHIDGND-UHFFFAOYSA-N
InChICode InChI=1S/C10H16O2/c1-7-5-4-6-10(2,3)8(7)9(11)12/h4-6H2,1-3H3,(H,11,12)
SMILES CC1=C(C(=O)O)C(C)(C)CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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