input word = C00048427

Metabolite InformationStructural formula
Name Impatienoside F
(+)-Impatienoside F
Formula C58H94O28
Mw 1238.59316242
CAS RN 1161733-96-5
C_ID C00048427 ,
InChIKey KCMJRVQUCCWUGK-ZYZRXOSFNA-N
InChICode InChI=1S/C58H94O28/c1-53(2)16-23-22-8-9-29-55(4)12-11-30(81-52-44(37(70)36(69)42(83-52)47(75)76)85-51-43(35(68)33(66)27(18-60)80-51)84-48-38(71)31(64)24(62)19-77-48)56(5,21-61)28(55)10-13-58(29,7)57(22,6)15-14-54(23,3)46(45(53)74)86-49-40(73)41(25(63)20-78-49)82-50-39(72)34(67)32(65)26(17-59)79-50/h8,23-46,48-52,59-74H,9-21H2,1-7H3,(H,75,76)/t23-,24+,25-,26+,27+,28+,29+,30-,31-,32+,33-,34-,35-,36-,37-,38+,39+,40+,41-,42-,43+,44+,45-,46+,48-,49-,50-,51-,52+,54+,55-,56+,57+,58+/m0/s1
SMILES C1[C@]2([C@H]([C@]([C@H](C1)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)CO)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)C(=O)O)(CO)C)CC[C@@]1([C@@H]2CC=C2[C@]1(CC[C@@]1([C@H]2CC([C@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)(C)C)C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBalsaminaceaeImpatiens siculifer Ref.
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OrganismImpatiens siculifer
ReferenceLi,Phytochem.,70,(2009),816