input word = C00031423

Metabolite InformationStructural formula
Name Trichurusin B
(+)-Trichurusin B
Formula C25H40O6
Mw 436.28248901
CAS RN 867183-03-7
C_ID C00031423 ,
InChIKey OCXVGVTWMGMEPW-DVYBMHRENA-N
InChICode InChI=1S/C25H40O6/c1-6-17(2)13-19(4)14-20(5)25-22(8-10-24(29)31-25)30-23(28)9-7-18(3)15-21(16-27)11-12-26/h6-7,9,15,19-22,25-27H,8,10-14,16H2,1-5H3/b9-7+,17-6+,18-15+/t19-,20-,21+,22-,25+/m1/s1
SMILES C/C=C(C)CC(C)CC(C)C1OC(=O)CCC1OC(=O)/C=C/C(C)=C/C(CO)CCO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeTrichurus terrophilus Ref.
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