input word = C00007913

Metabolite InformationStructural formula
Name Stillopsin
Formula C21H22O11
Mw 450.11621155
CAS RN 72241-26-0
C_ID C00007913 ,
InChIKey BQFASKRKRAPUFK-WSBUIGBBNA-N
InChICode InChI=1S/C21H22O11/c22-8-17-18(28)19(29)20(30)21(32-17)31-16-7-13(25)10(6-15(16)27)11(23)3-1-9-2-4-12(24)14(26)5-9/h1-7,17-22,24-30H,8H2/b3-1+/t17-,18-,19+,20-,21-/m1/s1
SMILES c1(cc(c(cc1O)C(=O)/C=C/c1cc(c(cc1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCoreopsis bigelovii Ref.
PlantaeAsteraceaeCoreopsis stillmanii Ref.
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