input word = C00034537

Metabolite InformationStructural formula
Name Hierapolitanin B
(+)-Hierapolitanin B
Formula C21H26O8
Mw 406.16276781
CAS RN 934825-25-9
C_ID C00034537 ,
InChIKey BWZISNOXEJHUTI-VJMUMWNZNA-N
InChICode InChI=1S/C21H26O8/c1-6-21(10-23)7-15(28-19(25)11(2)8-22)16-13(4)20(26)29-18(16)17(21)12(3)9-27-14(5)24/h6,15-18,22-23H,1-4,7-10H2,5H3/t15-,16+,17+,18-,21+/m0/s1
SMILES [C@@]1(C[C@@H]([C@@H]2[C@@H]([C@H]1C(=C)COC(=O)C)OC(=O)C2=C)OC(=O)C(=C)CO)(C=C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea hierapolitana Ref.
zoom in