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 c1(cc(cc(c1)/C=C/c1ccc(cc1)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeSchoenocaulon officinale Ref.
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