input word = C00044758

Metabolite InformationStructural formula
Name Ferruginin C
Formula C35H44O4
Mw 528.32395989
CAS RN 552298-17-6
C_ID C00044758 ,
InChIKey SUULLHWCJDOMBX-UHFFFAOYSA-N
InChICode InChI=1S/C35H44O4/c1-20(2)10-12-25-24(9)18-29(36)30-27(25)19-28-31(33(30)38)32(37)26(13-11-21(3)4)34(39)35(28,16-14-22(5)6)17-15-23(7)8/h10-11,14-15,18-19,36,38-39H,12-13,16-17H2,1-9H3
SMILES CC(C)=CCC1=C(O)C(CC=C(C)C)(CC=C(C)C)c2cc3c(CC=C(C)C)c(C)cc(O)c3c(O)c2C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeVismia macrophylla Ref.
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