input word = C00037297

Metabolite InformationStructural formula
Name Ilicifolioside B
Formula C25H44O16
Mw 600.26293536
CAS RN 599205-63-7
C_ID C00037297 ,
InChIKey QZVLTTWIHASKNB-ZHGPLEJENA-N
InChICode InChI=1S/C25H44O16/c1-2-11(6-4-3-5-7-26)38-25-22(41-24-21(35)18(32)16(30)13(8-27)39-24)19(33)17(31)14(40-25)10-37-23-20(34)15(29)12(28)9-36-23/h2,11-35H,1,3-10H2/t11-,12-,13+,14+,15-,16+,17+,18-,19-,20+,21+,22+,23-,24-,25+/m0/s1
SMILES [C@H]1(O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@@H](C=C)CCCCCO)CO[C@@H]2OC[C@@H]([C@@H]([C@H]2O)O)O)O)O)[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAcanthus ilicifolius Ref.
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