input word = C00033764

Metabolite InformationStructural formula
Name Dentatin C
(-)-Dentatin C
Formula C21H30O9
Mw 426.18898256
CAS RN 161168-03-2
C_ID C00033764 ,
InChIKey GHVUDSYPMZZROW-KVFUDRRZNA-N
InChICode InChI=1S/C21H30O9/c1-7-10-5-13(28-21-18(26)17(25)16(24)14(6-22)29-21)9(3)15(10)19-11(4-12(7)23)8(2)20(27)30-19/h8,10-19,21-26H,1,3-6H2,2H3/t8-,10+,11+,12+,13+,14-,15+,16-,17+,18-,19+,21-/m1/s1
SMILES [C@H]12[C@H](C(=C)[C@H](C[C@@H]3[C@@H]1OC(=O)[C@@H]3C)O)C[C@@H](C2=C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeIxeris dentata Nakai Ref.
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