input word = C00041352

Metabolite InformationStructural formula
Name Argeloside M
(-)-Argeloside M
Formula C55H88O23
Mw 1116.57163912
CAS RN 874118-59-9
C_ID C00041352 ,
InChIKey QDDIGHZZODHFSZ-VCEYCWQANA-N
InChICode InChI=1S/C55H88O23/c1-24-44(32(62-7)18-37(67-24)71-29-13-16-54(23-57)28(17-29)11-12-31-30(54)14-15-52(5)49-36-22-66-53(49,6)78-55(31,52)77-36)73-38-19-33(63-8)45(25(2)68-38)74-39-20-34(64-9)46(26(3)69-39)75-51-43(61)48(65-10)47(27(4)70-51)76-50-42(60)41(59)40(58)35(21-56)72-50/h11,24-27,29-51,56-61H,12-23H2,1-10H3/t24-,25-,26-,27-,29+,30+,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+/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)OC)O[C@H]1[C@@H]([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)O)C)OC)C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeSolenostemma argel Ref.
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