input word = C00063526

Metabolite InformationStructural formula
Name 4-[(2S,3S)-2,3-Dihydro-3-(hydroxymethyl)-5-[(1E)-3-hydroxy-1-propen-1-yl]-7-methoxy-2-benzofuranyl]-2-methoxyphenyl beta-D-glucopyranoside
Formula C26H32O11
Mw 520.19446187
CAS RN 96738-84-0
C_ID C00063526
InChIKey SPWHQAUMLDQOFU-JLVLPJHDSA-N
InChICode InChI=1S/C26H32O11/c1-33-18-10-14(5-6-17(18)35-26-23(32)22(31)21(30)20(12-29)36-26)24-16(11-28)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h3-6,8-10,16,20-24,26-32H,7,11-12H2,1-2H3/b4-3+/t16-,20-,21-,22+,23-,24-,26-/m1/s1
SMILES COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1OC1OC(CO)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus sinensis Ref.
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