input word = C00029843

Metabolite InformationStructural formula
Name Borassoside F
(-)-Borassoside F
Formula C51H82O20
Mw 1014.53994506
CAS RN 943518-98-7
C_ID C00029843 ,
InChIKey OZIHYFWYFUSXIS-ZLXYFHJDNA-N
InChICode InChI=1S/C51H82O20/c1-20-10-15-51(62-19-20)21(2)32-30(71-51)17-29-27-9-8-25-16-26(11-13-49(25,6)28(27)12-14-50(29,32)7)66-48-44(70-46-39(59)36(56)34(54)23(4)64-46)41(61)43(31(18-52)67-48)69-47-40(60)37(57)42(24(5)65-47)68-45-38(58)35(55)33(53)22(3)63-45/h8,20-24,26-48,52-61H,9-19H2,1-7H3/t20-,21-,22-,23-,24-,26-,27+,28-,29-,30-,31+,32-,33-,34-,35+,36+,37-,38+,39+,40+,41-,42-,43+,44+,45-,46-,47-,48+,49-,50-,51-/m0/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3C[C@H]2[C@@H]1[C@@H]([C@]1(O2)OC[C@H](CC1)C)C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)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)C)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePalmaeBorassus flabellifer Ref.
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