input word = C00041016

Metabolite InformationStructural formula
Name Isoplagiochin A
Formula C28H22O4
Mw 422.15180919
CAS RN 159194-77-1
C_ID C00041016 ,
InChIKey DLWONXBMHBQJCM-PLNGDYQASA-N
InChICode InChI=1S/C28H22O4/c29-22-10-13-28-21(17-22)9-6-20-8-12-27(31)25(16-20)24-15-19(7-11-26(24)30)5-4-18-2-1-3-23(14-18)32-28/h1-5,7-8,10-17,29-31H,6,9H2/b5-4-
SMILES Oc1ccc2c(c1)CCc1ccc(O)c(c1)-c1cc(ccc1O)/C=Cc1cccc(c1)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Heteroscyphus planus Ref.
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