input word = C00020697

Metabolite InformationStructural formula
Name Zoapatanolide D
Formula C22H26O8
Mw 418.16276781
CAS RN 90735-00-5
C_ID C00020697 ,
InChIKey HLEALBHOIZPSHG-XDRRJFSKNA-N
InChICode InChI=1S/C22H26O8/c1-7-8(2)20(25)28-16-9(3)12-14(17-13(15(16)24)10(4)21(26)29-17)22(6)19(30-22)18(12)27-11(5)23/h7,13-19,24H,4H2,1-3,5-6H3/b8-7-/t13-,14-,15+,16+,17-,18-,19+,22-/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@@H](O)[C@H](OC(=O)/C(C)=CC)C(C)=C1[C@H](OC(C)=O)[C@H]3O[C@@]3(C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMontanoa tomentosa Ref.
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