input word = C00063644

Metabolite InformationStructural formula
Name Momordicoside R
Formula C42H70O15
Mw 814.47147157
CAS RN 1096710-50-7
C_ID C00063644
InChIKey QELCMGMFRYOEMU-GTSNMIQSSA-N
InChICode InChI=1S/C42H70O15/c1-20(16-22(45)34(52)38(4,5)57-36-33(51)31(49)29(47)24(18-44)55-36)21-10-12-40(7)25-11-13-42-26(41(25,19-53-42)15-14-39(21,40)6)8-9-27(37(42,2)3)56-35-32(50)30(48)28(46)23(17-43)54-35/h11,13,20-36,43-52H,8-10,12,14-19H2,1-7H3/t20-,21-,22-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32-,33-,34+,35+,36+,39-,40+,41+,42-/m1/s1
SMILES CC(CC(O)C(O)C(C)(C)OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C3C=CC45OCC3(CCC12C)C4CCC(OC1OC(CO)C(O)C(O)C1O)C5(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
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