input word = C00044936

Metabolite InformationStructural formula
Name Modiolin
Formula C12H20O3
Mw 212.1412445
CAS RN 506435-49-0
C_ID C00044936 ,
InChIKey LTHMZLZFQXPZHS-BTRMARETNA-N
InChICode InChI=1S/C12H20O3/c1-3-15-12(14)10-8-6-4-5-7-9-11(2)13/h4,6,8,10-11,13H,3,5,7,9H2,1-2H3/b6-4+,10-8-/t11-/m1/s1
SMILES O(C(=O)/C=C\C=C\CCC[C@@H](C)O)CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMontagnulaceaeParaphaeosphaeria sp. N-119 Ref.
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