input word = C00032964

Metabolite InformationStructural formula
Name Eupteleasaponin VI
(+)-Eupteleasaponin VI
Formula C47H72O18
Mw 924.4718655
CAS RN 290809-37-9
C_ID C00032964 ,
InChIKey IWZZBOZUFJOAFX-JWODHMQNNA-N
InChICode InChI=1S/C47H72O18/c1-19-8-13-46-15-14-45(7)44(6)12-9-23-42(3,4)25(10-11-43(23,5)36(44)35-37(62-35)47(45,24(46)16-19)65-41(46)57)61-40-34(64-38-31(55)29(53)26(50)20(2)58-38)33(28(52)22(18-49)60-40)63-39-32(56)30(54)27(51)21(17-48)59-39/h20-40,48-56H,1,8-18H2,2-7H3/t20-,21+,22+,23-,24+,25-,26-,27+,28+,29+,30-,31+,32+,33-,34+,35-,36+,37-,38-,39-,40-,43-,44+,45-,46-,47+/m0/s1
SMILES [C@@H]12[C@@]([C@@H]3[C@@](CC2)([C@]2([C@]4([C@@H]5[C@H]3O5)[C@H]3[C@](CC2)(C(=O)O4)CCC(=C)C3)C)C)(CC[C@@H](C1(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)CO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEupteleaceaeEuptelea polyandra SIEB.et ZUCC Ref.
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OrganismEuptelea polyandra SIEB.et ZUCC
ReferenceMurakami,Chem.Pharm.Bull.,49,(2001),741