input word = C00019243

Metabolite InformationStructural formula
Name Mulberroside E
Formula C26H32O13
Mw 552.18429111
CAS RN 193483-94-2
C_ID C00019243 ,
InChIKey YGQPMDDXSJHKJT-DYYKPFNBNA-N
InChICode InChI=1S/C26H32O13/c27-10-17-19(30)21(32)23(34)25(38-17)36-15-5-3-12(4-6-15)1-2-13-7-14(29)9-16(8-13)37-26-24(35)22(33)20(31)18(11-28)39-26/h1-9,17-35H,10-11H2/b2-1+/t17-,18-,19+,20+,21+,22+,23-,24-,25-,26-/m1/s1
SMILES OCC1O[C@@H](Oc2ccc(/C=C/c3cc(O)cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3)cc2)C(O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeSchoenocaulon officinale Ref.
zoom in