input word = C00043511

Metabolite InformationStructural formula
Name Fraxiresinol 4'-O-beta-D-glucopyranoside
(-)-Fraxiresinol 4'-O-beta-D-glucopyranoside
Formula C27H34O13
Mw 566.19994117
CAS RN 745835-63-6
C_ID C00043511 ,
InChIKey OTMTZTOMTOXZLO-IPSDZVPNNA-N
InChICode InChI=1S/C27H34O13/c1-34-16-6-12(4-5-15(16)39-26-23(32)22(31)21(30)19(9-28)40-26)24-14-10-37-25(27(14,33)11-38-24)13-7-17(35-2)20(29)18(8-13)36-3/h4-8,14,19,21-26,28-33H,9-11H2,1-3H3/t14-,19-,21-,22+,23-,24-,25-,26-,27-/m1/s1
SMILES O1C[C@H]2[C@@]([C@H]1c1cc(c(c(c1)OC)O)OC)(CO[C@@H]2c1cc(c(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana prionophylla Ref.
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