input word = C00031811

Metabolite InformationStructural formula
Name Genameside C
(-)-Genameside C
Formula C23H34O16
Mw 566.18468504
CAS RN 872422-69-0
C_ID C00031811 ,
InChIKey CPILLEDKLYPDNE-JNOWITIGNA-N
InChICode InChI=1S/C23H34O16/c1-34-19(32)9-6-35-20(12-8(9)2-3-23(12,33)7-26)39-22-17(31)15(29)18(11(5-25)37-22)38-21-16(30)14(28)13(27)10(4-24)36-21/h2-3,6,8,10-18,20-22,24-31,33H,4-5,7H2,1H3/t8-,10+,11+,12+,13+,14-,15+,16+,17+,18+,20-,21-,22-,23-/m0/s1
SMILES COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1C=C[C@@]2(O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeGenipa americana L. Ref.
PlantaeScrophulariaceaeRehmannia glutinosa Ref.
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