input word = C00010558

Metabolite InformationStructural formula
Name [2aR-(2aalpha,3beta,4alpha,7balpha)]-3-(beta-D-Gucopyranosyloxy)-2a,3,4,4a,5,7b-hexahydro-4a-hydroxy-4-methyl-1H-2,6-dioxacyclopent[cd]inden-1-one
Formula C16H22O10
Mw 374.12129692
CAS RN 110322-49-1
C_ID C00010558 ,
InChIKey AZDPGDNGMGSZEZ-HQOHMKMCNA-N
InChICode InChI=1S/C16H22O10/c1-5-12(26-15-11(20)10(19)9(18)7(2-17)24-15)13-8-6(14(21)25-13)3-23-4-16(5,8)22/h3,5,7-13,15,17-20,22H,2,4H2,1H3/t5-,7+,8-,9+,10-,11-,12-,13+,15-,16-/m0/s1
SMILES C[C@H]1[C@H](O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)[C@@H]2OC(=O)C3=COC[C@@]1(O)[C@@H]32
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGelsemiaceaeGelsemium sempervirens Ref.
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