input word = C00060295

Metabolite InformationStructural formula
Name 4-[1,3-Dihydroxy-2-[4-(3-hydroxypropyl)-2-methoxyphenoxy]propyl]-2-methoxyphenyl beta-D-xylopyranoside
Formula C25H34O11
Mw 510.21011193
CAS RN 167638-63-3
C_ID C00060295
InChIKey WKWOMGUCNMHNPD-AHMSHWCLSA-N
InChICode InChI=1S/C25H34O11/c1-32-19-10-14(4-3-9-26)5-7-17(19)35-21(12-27)22(29)15-6-8-18(20(11-15)33-2)36-25-24(31)23(30)16(28)13-34-25/h5-8,10-11,16,21-31H,3-4,9,12-13H2,1-2H3/t16-,21?,22?,23+,24-,25+/m1/s1
SMILES COc1cc(CCCO)ccc1OC(CO)C(O)c1ccc(OC2OCC(O)C(O)C2O)c(OC)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePicea abies Ref.
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