input word = C00041351

Metabolite InformationStructural formula
Name Argeloside L
(-)-Argeloside L
Formula C56H88O23
Mw 1128.57163912
CAS RN 874118-58-8
C_ID C00041351 ,
InChIKey WTSRDWWLWHSPEH-RHPGURBSNA-N
InChICode InChI=1S/C56H88O23/c1-25-47(74-42-21-37(65-10)50(28(4)71-42)77-52-46(62)45(61)44(60)38(22-57)73-52)34(59)18-40(68-25)75-48-27(3)70-43(20-36(48)64-9)76-49-26(2)69-41(19-35(49)63-8)72-31-13-16-55(24-66-29(5)58)30(17-31)11-12-33-32(55)14-15-53(6)51-39-23-67-54(51,7)79-56(33,53)78-39/h11,25-28,31-52,57,59-62H,12-24H2,1-10H3/t25-,26-,27-,28-,31+,32+,33-,34-,35+,36-,37-,38-,39-,40+,41+,42+,43+,44+,45+,46-,47-,48-,49-,50-,51+,52+,53-,54-,55-,56+/m1/s1
SMILES [C@]123[C@@H]4CC=C5[C@@]([C@H]4CC[C@@]1([C@H]1[C@@](O2)(OC[C@H]1O3)C)C)(CC[C@@H](C5)O[C@@H]1O[C@@H]([C@H]([C@H](C1)OC)O[C@H]1C[C@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@@H]([C@H]([C@@H](C1)O)O[C@H]1C[C@H]([C@@H]([C@H](O1)C)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)OC)C)OC)C)COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeSolenostemma argel Ref.
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