input word = C00062354

Metabolite InformationStructural formula
Name Ginsenoside C-Y1
Formula C42H74O14
Mw 802.50785707
CAS RN 592550-52-2
C_ID C00062354
InChIKey QPUKYMBRXDUSAZ-LRDVQNGZSA-N
InChICode InChI=1S/C42H74O14/c1-37(2,51)13-9-14-42(8,52)21-10-16-41(7)28(21)22(45)18-26-39(5)15-12-27(38(3,4)25(39)11-17-40(26,41)6)55-36-34(32(49)30(47)24(20-44)54-36)56-35-33(50)31(48)29(46)23(19-43)53-35/h21-36,43-52H,9-20H2,1-8H3/t21-,22+,23+,24+,25-,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,39-,40+,41+,42-/m0/s1
SMILES CC(C)(O)CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
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