input word = C00043500

Metabolite InformationStructural formula
Name Eupachinilide I
(+)-Eupachinilide I
Formula C22H28O7
Mw 404.18350325
CAS RN 691851-98-6
C_ID C00043500 ,
InChIKey GHYQAZLCOXMXSD-VRZUJURANA-N
InChICode InChI=1S/C22H28O7/c1-12-8-17(24)9-13(2)11-19-20(15(4)22(26)29-19)18(10-12)28-21(25)14(3)6-7-27-16(5)23/h6,8,11,17-20,24H,4,7,9-10H2,1-3,5H3/b12-8-,13-11+,14-6-/t17-,18-,19+,20-/m1/s1
SMILES [C@H]1(/C=C(\C[C@H]([C@@H]2[C@H](/C=C(/C1)\C)OC(=O)C2=C)OC(=O)/C(=C\COC(=O)C)/C)/C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium chinense Ref.
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