input word = C00012273

Metabolite InformationStructural formula
Name Linearilobin C
Formula C22H28O8
Mw 420.17841787
CAS RN 75683-57-7
C_ID C00012273 ,
InChIKey HHADEQZTJCWSAJ-XSUCNCDTNA-N
InChICode InChI=1S/C22H28O8/c1-13(7-8-23)21(26)29-18-9-16(11-24)5-4-6-17(12-28-15(3)25)10-19-20(18)14(2)22(27)30-19/h5,7,10,18-20,23-24H,2,4,6,8-9,11-12H2,1,3H3/b13-7+,16-5-,17-10-/t18-,19-,20?/m1/s1
SMILES [C@@H]12[C@H](OC(=O)C1=C)/C=C(/CC/C=C(/C[C@H]2OC(=O)/C(=C/CO)/C)\CO)\COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium linearilobum Ref.
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