input word = C00044935

Metabolite InformationStructural formula
Name Modiolide B
Formula C10H14O3
Mw 182.09429431
CAS RN 506435-48-9
C_ID C00044935 ,
InChIKey DNUDFISZTSNQPJ-VZAPGUCBNA-N
InChICode InChI=1S/C10H14O3/c1-8-4-2-3-5-9(11)6-7-10(12)13-8/h3,5-9,11H,2,4H2,1H3/b5-3+,7-6-/t8-,9-/m1/s1
SMILES C\1=C\C(=O)O[C@@H](CC/C=C/[C@H]1O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMontagnulaceaeParaphaeosphaeria sp. N-119 Ref.
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