input word = C00019873

Metabolite InformationStructural formula
Name Frachinoside
Formula C32H38O19
Mw 726.20072904
CAS RN 142902-27-0
C_ID C00019873 ,
InChIKey YNOUJPHGTJKBFJ-ICNIYPHDNA-N
InChICode InChI=1S/C32H38O19/c1-3-13-14(15(29(43)44-2)10-46-30(13)51-32-28(42)25(39)23(37)19(9-33)49-32)7-22(36)45-11-20-24(38)26(40)27(41)31(50-20)48-18-8-17-12(6-16(18)34)4-5-21(35)47-17/h3-6,8,10,13-14,19-20,23-28,30-34,37-42H,1,7,9,11H2,2H3/t13-,14+,19+,20+,23-,24-,25+,26+,27-,28-,30-,31-,32+/m1/s1
SMILES [C@@H]1([C@H]([C@H](OC=C1C(=O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)C=C)CC(=O)OC[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)Oc1c(cc2c(c1)oc(=O)cc2)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeFraxinus chinensis Ref.
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