input word = C00063433

Metabolite InformationStructural formula
Name Floralginsenoside H
Formula C50H84O21
Mw 1020.55050975
CAS RN 937171-08-9
C_ID C00063433
InChIKey RSDKNHWOXVSQLB-HMAXXWIGSA-N
InChICode InChI=1S/C50H84O21/c1-22(2)26(71-63)11-17-50(9,70-44-41(62)37(58)34(55)27(19-51)65-44)24-10-15-49(8)33(24)25(54)18-31-47(6)14-13-32(46(4,5)30(47)12-16-48(31,49)7)68-45-42(39(60)35(56)28(20-52)66-45)69-43-40(61)38(59)36(57)29(67-43)21-64-23(3)53/h24-45,51-52,54-63H,1,10-21H2,2-9H3/t24-,25+,26?,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,37-,38-,39-,40+,41+,42+,43-,44-,45-,47-,48+,49+,50-/m0/s1
SMILES C=C(C)C(CCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(COC(C)=O)C(O)C(O)C4O)C(C)(C)C3CCC12C)OO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
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