input word = C00005814

Metabolite InformationStructural formula
Name Ikarisoside C
Formula C38H48O20
Mw 824.27389398
CAS RN 113558-11-5
C_ID C00005814 ,
InChIKey WCUYANMOZSMFCP-GXSROHPBNA-N
InChICode InChI=1S/C38H48O20/c1-13(2)4-9-17-19(53-36-30(50)27(47)24(44)20(11-39)54-36)10-18(42)22-26(46)34(32(56-33(17)22)15-5-7-16(41)8-6-15)57-38-35(29(49)23(43)14(3)52-38)58-37-31(51)28(48)25(45)21(12-40)55-37/h4-8,10,14,20-21,23-25,27-31,35-45,47-51H,9,11-12H2,1-3H3/t14-,20+,21-,23+,24+,25+,27+,28-,29+,30-,31+,35+,36-,37+,38+/m1/s1
SMILES CC(C)=CCc1c(O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)cc(O)c2c(=O)c(O[C@@H]3OC(C)[C@H](O)[C@H](O)C3O[C@@H]3OC(CO)[C@@H](O)C(O)C3O)c(-c3ccc(O)cc3)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeEpimedium diphyllum Ref.
PlantaeBerberidaceaeEpimedium grandiflorum Ref.
PlantaeBerberidaceaeEpimedium koreanum Ref.
PlantaeBerberidaceaeEpimedium sempervirens Ref.
PlantaeBerberidaceaeVancouveria hexandra Ref.
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