input word = C00012867

Metabolite InformationStructural formula
Name beta-Cyclotanacin
Chrysanin
Taxillin
[3aR-[3aalpha,4alpha(Z),4aalpha,8beta,8abeta,9abeta]]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid
Formula C20H26O5
Mw 346.17802394
CAS RN 34226-89-6
C_ID C00012867 ,
InChIKey CCJPWAPOFONQQT-CMHQOHOJNA-N
InChICode InChI=1S/C20H26O5/c1-6-10(2)18(22)25-17-15-12(4)19(23)24-13(15)9-20(5)14(21)8-7-11(3)16(17)20/h6,13-17,21H,3-4,7-9H2,1-2,5H3/b10-6-/t13-,14+,15-,16?,17-,20-/m0/s1
SMILES C1(=C)[C@H]2[C@]([C@@H](CC1)O)(C[C@H]1[C@@H]([C@@H]2OC(=O)/C(=C\C)/C)C(=C)C(=O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChrysanthemum cineraiaefolium Ref.
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