input word = C00032561

Metabolite InformationStructural formula
Name (-)-Massoniresinol 4'-O-beta-D-glucopyranoside
Formula C26H34O13
Mw 554.19994117
CAS RN 448939-03-5
C_ID C00032561 ,
InChIKey LKGFEKMPODZEFI-RFGRNBNLNA-N
InChICode InChI=1S/C26H34O13/c1-35-17-7-13(3-5-15(17)29)9-25(33)12-37-23(26(25,34)11-28)14-4-6-16(18(8-14)36-2)38-24-22(32)21(31)20(30)19(10-27)39-24/h3-8,19-24,27-34H,9-12H2,1-2H3/t19-,20-,21+,22-,23-,24-,25-,26+/m1/s1
SMILES COc1cc(C[C@@]2(O)CO[C@H](c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@]2(O)CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeSambucus sieboldiana (MIQ.) BLUME ex.GRAEBN Ref.
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