input word = C00005826

Metabolite InformationStructural formula
Name Epimedin B
Formula C38H48O19
Mw 808.27897935
CAS RN 110623-73-9
C_ID C00005826 ,
InChIKey OCZZCFAOOWZSRX-RZPZIFEZNA-N
InChICode InChI=1S/C38H48O19/c1-14(2)5-10-18-21(53-37-31(49)28(46)26(44)22(12-39)54-37)11-19(40)23-27(45)34(32(55-33(18)23)16-6-8-17(50-4)9-7-16)56-38-35(29(47)24(42)15(3)52-38)57-36-30(48)25(43)20(41)13-51-36/h5-9,11,15,20,22,24-26,28-31,35-44,46-49H,10,12-13H2,1-4H3/t15-,20-,22-,24-,25-,26+,28-,29-,30-,31+,35-,36-,37+,38-/m0/s1
SMILES c1(cc(c2c(c1CC=C(C)C)oc(c(c2=O)O[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)C)O)O)O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)c1ccc(cc1)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeEpimedium diphyllum Ref.
PlantaeBerberidaceaeEpimedium koreanum Ref.
PlantaeBerberidaceaeEpimedium sagittatum Ref.
PlantaeBerberidaceaeEpimedium wushanense Ref.
PlantaeBerberidaceaeVancouveria hexandra Ref.
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