input word = C00031196

Metabolite InformationStructural formula
Name Rossicasin B
(-)-Rossicasin B
Formula C20H28O11
Mw 444.16316174
CAS RN 886465-83-4
C_ID C00031196 ,
InChIKey YCTDNVHNLSTJIK-QWTDPEKZNA-N
InChICode InChI=1S/C20H28O11/c21-11-5-3-10(4-6-11)2-1-7-28-20-18(27)16(25)15(24)13(31-20)9-30-19-17(26)14(23)12(22)8-29-19/h1-6,12-27H,7-9H2/b2-1+/t12-,13+,14-,15-,16-,17-,18+,19-,20+/m0/s1
SMILES [C@H]1(O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)OC/C=C/c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrobanchaceaeBoschniakia rossica (CHAM.et SCHLECH.) FEDTSCH.et FLEROV. Ref.
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