The Scientific World Journal / 2022 / Article / Tab 2 / Research Article
Active Antialopecia Chemical Identification of Merremia peltata Leaves and Computational Study toward Androgen Receptor Using Molecular Docking and Molecular Dynamic Simulation Table 2 Identification of compounds in M. peltata leaf extract fractions using liquid chromatography–mass spectrometry (LC-MS/MS).
Fraction Compound Observed Rt (min) Observed m/z F1 (E)-Hexadecyl-ferulate 10.74 441.2979 Bufotalinin 9.85 415.2121 Cerevisterol 12.01 453.3342 Stigmastan-3,6-dione 10.96 429.3725 Candidate mass C35 H66 O6 12.02 605.4751 F2 3-Tert-butyl-4-methoxyphenol 9.70 181.1223 Erythrocentaurin 9.12 177.0545 Trans-ferulaldehyde 8.93 179.0702 Candidate mass C54 H78 O10 12.04 887.5681 Candidate mass C54 H78 O11 11.92 903.5632 F3 Digiprolactone 7.26 197.1173 Kushenol M 9.92 509.2534 Shanciol B 9.67 423.1796 Candidate mass C26 H48 O14 10.25 607.2926 Candidate mass C26 H46 O15 10.11 621.2721 F4 5,7,2′,5′-Tetrahydroxy-flavone 8.22 287.0554 7-Hydroxy-5-methoxycoumarin 6.49 193.0497 Kushenol M 9.77 509.2535 Methyl gallate 4.89 185.0444 Candidate mass C30 H31 O7 9.96 505.2228 F5 5,7,2′,5′-Tetrahydroxy-flavone 8.23 287.0552 Epigallocatechin (4β ,8)-gallocatechin 7.48 611.1406 Kaempferol-3-O-β -D-glucopyranoside 6.23 449.1082 Kaempferol-7-O-α -L-rhamnoside 6.04 433.1132 Tiliroside 8.07 595.1451
