input word = C00013239

Metabolite InformationStructural formula
Name Emmotin F
(2R-trans)-3,4-Dihydro-2-hydroxy-3-(1-hydroxy-1-methylethyl)-5,8-dimethyl-1(2H)-naphthalenone
Formula C15H20O3
Mw 248.1412445
CAS RN 61263-72-7
C_ID C00013239 ,
InChIKey JNGKSECPHZPRSM-VEZULTJBNA-N
InChICode InChI=1S/C15H20O3/c1-8-5-6-9(2)12-10(8)7-11(15(3,4)18)13(16)14(12)17/h5-6,11,13,16,18H,7H2,1-4H3/t11-,13+/m0/s1
SMILES c12C(=O)[C@@H]([C@H](Cc1c(ccc2C)C)C(C)(C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIcacinaceaeEmmotum nitens Ref.
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