input word = C00029310

Metabolite InformationStructural formula
Name (20E)-Ginsenoside F4
(-)-(20E)-Ginsenoside F4
Ginsenoside F4
Formula C42H70O12
Mw 766.4867277
CAS RN 181225-33-2
C_ID C00029310 ,
InChIKey QOMBXPYXWGTFNR-VUNPYZRRNA-N
InChICode InChI=1S/C42H70O12/c1-20(2)11-10-12-21(3)23-13-16-41(8)29(23)24(44)17-27-40(7)15-14-28(45)39(5,6)36(40)25(18-42(27,41)9)52-38-35(33(49)31(47)26(19-43)53-38)54-37-34(50)32(48)30(46)22(4)51-37/h11-12,22-38,43-50H,10,13-19H2,1-9H3/b21-12+/t22-,23+,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,34+,35+,36-,37-,38+,40+,41+,42+/m0/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](C[C@@H]2O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)O)O)O)([C@]2([C@H]([C@@H](C1)O)[C@H](CC2)/C(=C/CC=C(C)C)/C)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng C.A.Meyer Ref.
PlantaeAraliaceaePanax quinquefolium Ref.
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OrganismPanax ginseng C.A.Meyer
ReferenceCheng,Phytochem.,69,(2008),218