input word = C00012644

Metabolite InformationStructural formula
Name Isotrichodermol
3-Hydroxytrichothecene
Formula C15H22O3
Mw 250.15689457
CAS RN 104155-10-4
C_ID C00012644 ,
InChIKey ICJDGHMOMSQSLB-AEJBIYPHNA-N
InChICode InChI=1S/C15H22O3/c1-9-4-5-13(2)11(6-9)18-12-10(16)7-14(13,3)15(12)8-17-15/h6,10-12,16H,4-5,7-8H2,1-3H3/t10-,11-,12-,13+,14-,15-/m1/s1
SMILES C1[C@]2([C@@H](C=C(C1)C)O[C@H]1[C@]3([C@@]2(C[C@H]1O)C)OC3)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiNectriaceaeFusarium sp. Ref.
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