input word = C00000840

Metabolite InformationStructural formula
Name alpha-Campholonic acid
Formula C10H16O3
Mw 184.10994438
CAS RN 24268-17-5
C_ID C00000840 ,
InChIKey VRCGDJCVKWWRME-UHFFFAOYNA-N
InChICode InChI=1S/C10H16O3/c1-6-8(11)4-7(5-9(12)13)10(6,2)3/h6-7H,4-5H2,1-3H3,(H,12,13)/t6-,7-/m0/s1
SMILES C1(=O)C[C@H](C([C@H]1C)(C)C)CC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia officinalis Ref.
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