input word = C00033071

Metabolite InformationStructural formula
Name Jasnudifloside C
(-)-Jasnudifloside C
Formula C43H60O22
Mw 928.3576236
CAS RN 244230-42-0
C_ID C00033071 ,
InChIKey QEHQBLYCUVJSGZ-XWSXVKFGNA-N
InChICode InChI=1S/C43H60O22/c1-6-19-22(25(38(54)56-5)15-59-40(19)64-42-36(52)34(50)32(48)28(11-44)62-42)9-30(46)57-14-24-18(4)27-8-21(24)17(3)13-58-39(55)26-16-60-41(20(7-2)23(26)10-31(47)61-27)65-43-37(53)35(51)33(49)29(12-45)63-43/h6-7,15-18,21-24,27-29,32-37,40-45,48-53H,8-14H2,1-5H3/b19-6+,20-7+/t17-,18+,21+,22-,23-,24-,27-,28+,29+,32+,33+,34-,35-,36+,37+,40-,41-,42-,43-/m0/s1
SMILES O([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)[C@@H]1OC=C2[C@H](/C/1=C\C)CC(=O)O[C@@H]1[C@@H]([C@@H]([C@@H]([C@H](COC2=O)C)C1)COC(=O)C[C@H]1/C(=C\C)/[C@@H](OC=C1C(=O)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeJasminum nudiflorum Ref.
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OrganismJasminum nudiflorum
ReferenceTakenaka,Chem.Pharm.Bull.,50,(2002),384