input word = C00035329

Metabolite InformationStructural formula
Name Isophorene
Formula C14H28N4S2
Mw 316.17553838
CAS RN 57898-05-2
C_ID C00035329 ,
InChIKey KEJFAGMNOBNFJR-UHFFFAOYNA-N
InChICode InChI=1S/C14H28N4S2/c1-13(2)6-10(18-12(20)16-5)7-14(3,8-13)9-17-11(19)15-4/h10H,6-9H2,1-5H3,(H2,15,17,19)(H2,16,18,20)/t10-,14-/m1/s1
SMILES [C@H]1(CC(C[C@@](C1)(CNC(=S)NC)C)(C)C)NC(=S)NC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-His Cholesterol
Organism
Kingdom Family Species Reference
PlantaeLabiataeMentha pulegium L. Ref.
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