input word = C00032965

Metabolite InformationStructural formula
Name Eupteleasaponin VII
(-)-Eupteleasaponin VII
Formula C53H82O22
Mw 1070.52977431
CAS RN 290809-40-4
C_ID C00032965 ,
InChIKey ICYDXDXQYVVJDU-NNPFKENINA-N
InChICode InChI=1S/C53H82O22/c1-20-9-14-52-16-15-51(8)50(7)13-10-25-48(4,5)27(11-12-49(25,6)41(50)40-42(71-40)53(51,26(52)17-20)75-47(52)65)70-46-39(74-44-35(63)32(60)29(57)22(3)67-44)38(73-45-36(64)33(61)30(58)23(18-54)68-45)37(24(19-55)69-46)72-43-34(62)31(59)28(56)21(2)66-43/h21-46,54-64H,1,9-19H2,2-8H3/t21-,22-,23+,24+,25-,26+,27-,28-,29-,30+,31+,32+,33-,34+,35+,36+,37+,38-,39+,40-,41+,42-,43-,44-,45-,46-,49-,50+,51-,52-,53+/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[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)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