input word = C00057827

Metabolite InformationStructural formula
Name Tragoponol
Formula C32H28O10
Mw 572.16824712
CAS RN 1221233-19-7
C_ID C00057827
InChIKey VFBBOUIQPCYYQF-NSOVKSMOSA-N
InChICode InChI=1S/C32H28O10/c1-39-23-9-5-18(6-10-23)27-13-19-11-22(34)15-25(35)29(19)31(37)42-28(17-3-7-21(33)8-4-17)14-20-12-24(40-2)16-26(36)30(20)32(38)41-27/h3-12,15-16,27-28,33-36H,13-14H2,1-2H3/t27-,28-/m0/s1
SMILES COc1ccc([C@@H]2Cc3cc(O)cc(O)c3C(=O)O[C@H](c3ccc(O)cc3)Cc3cc(OC)cc(O)c3C(=O)O2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTragopogon porrifolius Ref.
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