input word = C00032238

Metabolite InformationStructural formula
Name Sublanceoside H5
(-)-Sublanceoside H5
Formula C47H72O18
Mw 924.4718655
CAS RN 923021-29-8
C_ID C00032238 ,
InChIKey UDXYGRVMRBJWDC-HDQCYJDJNA-N
InChICode InChI=1S/C47H72O18/c1-21-26(13-14-57-21)27-11-12-29-28(39(27)50)10-9-25-15-31(30(49)19-47(25,29)5)61-36-16-32(54-6)43(22(2)58-36)63-37-17-33(55-7)44(23(3)59-37)64-38-18-34(56-8)45(24(4)60-38)65-46-42(53)41(52)40(51)35(20-48)62-46/h9,13-14,22-24,27-38,40-46,48-49,51-53H,10-12,15-20H2,1-8H3/t22-,23-,24+,27+,28-,29+,30-,31-,32+,33+,34-,35-,36+,37+,38+,40-,41+,42-,43-,44-,45+,46+,47+/m1/s1
SMILES C1[C@H](C(=O)[C@H]2[C@H](C1)[C@@]1(C(=CC2)C[C@H]([C@@H](C1)O)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)CO)O)O)O)C)OC)C)C)c1c(occ1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCynanchum sublanceolatum Ref.
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