input word = C00045228

Metabolite InformationStructural formula
Name Beesioside C
(+)-Beesioside C
Formula C35H58O10
Mw 638.40299807
CAS RN 401837-70-5
C_ID C00045228 ,
InChIKey NDUOSBHDSRPZMK-IWUQVETJNA-N
InChICode InChI=1S/C35H58O10/c1-29(2)20-7-8-21-31(5)13-18(37)27(32(6)11-9-24(45-32)30(3,4)42)35(31,17-36)22(39)14-34(21)16-33(20,34)12-10-23(29)44-28-26(41)25(40)19(38)15-43-28/h18-28,36-42H,7-17H2,1-6H3/t18-,19+,20-,21-,22-,23-,24+,25-,26+,27+,28-,31-,32-,33+,34-,35+/m0/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](OC1)O[C@H]1CC[C@@]23[C@H](C1(C)C)CC[C@@H]1[C@]2(C[C@@H]([C@]2([C@]1(C[C@@H]([C@@H]2[C@]1(O[C@H](CC1)C(O)(C)C)C)O)C)CO)O)C3)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeBeesia calthaefolia Ref.
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