| 序号 | MOLID | 化合物 | OB/% | DL |
| 1 | MOL000296 | hederagenin | 36.91 | 0.8 |
| 2 | MOL003182 | (+)-Medioresinol di-O-beta-D-glucopyranoside_qt | 60.69 | 0.6 |
| 3 | MOL003184 | 81827-74-9 | 45.42 | 0.5 |
| 4 | MOL003185 | (1R,4aR,10aS)-5-hydroxy-1-(hydroxymethyl)-7-isopropyl- 8-methoxy-1,4a-dimethyl-4,9,10,10a-tetrahydro-3H- phenanthren-2-one | 48.84 | 0.4 |
| 5 | MOL003187 | triptolide | 51.29 | 0.7 |
| 6 | MOL003188 | Tripchlorolide | 78.72 | 0.7 |
| 7 | MOL003189 | WILFORLIDE A | 35.66 | 0.7 |
| 8 | MOL003192 | Triptonide | 67.66 | 0.7 |
| 9 | MOL003196 | Tryptophenolide | 48.5 | 0.4 |
| 10 | MOL003198 | 5 alpha-Benzoyl-4 alpha-hydroxy-1 beta,8 alpha-dinicotinoyl- dihydro-agarofuran | 35.26 | 0.7 |
| 11 | MOL003199 | 5,8-Dihydroxy-7-(4-hydroxy-5-methyl-coumarin-3)-coumarin | 61.85 | 0.5 |
| 12 | MOL003206 | Canin | 77.41 | 0.3 |
| 13 | MOL003208 | Celafurine | 72.94 | 0.4 |
| 14 | MOL003209 | Celallocinnine | 83.47 | 0.6 |
| 15 | MOL003210 | Celapanine | 30.18 | 0.8 |
| 16 | MOL003211 | Celaxanthin | 47.37 | 0.6 |
| 17 | MOL003217 | Isoxanthohumol | 56.81 | 0.4 |
| 18 | MOL003222 | Salazinic acid | 36.34 | 0.8 |
| 19 | MOL003224 | Tripdiotolnide | 56.4 | 0.7 |
| 20 | MOL003225 | Hypodiolide A | 76.13 | 0.5 |
| 21 | MOL003229 | Triptinin B | 34.73 | 0.3 |
| 22 | MOL003231 | Triptoditerpenic acid B | 40.02 | 0.4 |
| 23 | MOL003232 | Triptofordin B1 | 39.55 | 0.8 |
| 24 | MOL003233 | Triptofordin B2 | 107.7 | 0.8 |
| 25 | MOL003234 | Triptofordin C2 | 30.16 | 0.8 |
| 26 | MOL003235 | Triptofordin D1 | 32 | 0.8 |
| 27 | MOL003236 | Triptofordin D2 | 30.38 | 0.7 |
| 28 | MOL003238 | Triptofordin F1 | 33.91 | 0.6 |
| 29 | MOL003239 | Triptofordin F2 | 33.62 | 0.7 |
| 30 | MOL003241 | Triptofordin F4 | 31.37 | 0.7 |
| 31 | MOL003242 | Triptofordinine A2 | 30.78 | 0.5 |
| 32 | MOL003244 | Triptonide | 68.45 | 0.7 |
| 33 | MOL003245 | Triptonoditerpenic acid | 42.56 | 0.4 |
| 34 | MOL003248 | Triptonoterpene | 48.57 | 0.3 |
| 35 | MOL003266 | 21-Hydroxy-30-norhopan-22-one | 34.11 | 0.8 |
| 36 | MOL003267 | Wilformine | 46.32 | 0.2 |
| 37 | MOL003278 | salaspermic acid | 32.19 | 0.6 |
| 38 | MOL003279 | 99694-86-7 | 75.23 | 0.7 |
| 39 | MOL003280 | TRIPTONOLIDE | 49.51 | 0.5 |
| 40 | MOL000358 | beta-sitosterol | 36.91 | 0.8 |
| 41 | MOL000211 | Mairin | 55.38 | 0.8 |
| 42 | MOL000422 | kaempferol | 41.88 | 0.2 |
| 43 | MOL000449 | Stigmasterol | 43.83 | 0.8 |
| 44 | MOL002058 | 40957-99-1 | 57.2 | 0.6 |
| 45 | MOL003283 | (2R,3R,4S)-4-(4-hydroxy-3-methoxy-phenyl)-7- methoxy-2,3-dimethylol-tetralin-6-ol | 66.51 | 0.4 |
| 46 | MOL004443 | Zhebeiresinol | 58.72 | 0.2 |
| 47 | MOL005828 | nobiletin | 61.67 | 0.5 |
| 48 | MOL007415 | [(2S)-2-[[(2S)-2-(benzoylamino)-3-phenylpropanoyl]amino]- 3-phenylpropyl] acetate | 58.02 | 0.5 |
| 49 | MOL007535 | (5S,8S,9S,10R,13R,14S,17R)-17-[(1R,4R)-4-ethyl-1,5- dimethylhexyl]-10,13-dimethyl-2,4,5,7,8,9,11,12,14,15,16,17- dodecahydro-1H-cyclopenta[a]phenanthrene-3,6-dione | 33.12 | 0.8 |
| 50 | MOL009386 | 3,3’-bis-(3,4-dihydro-4-hydroxy-6-methoxy)-2H-1-benzopyran | 52.11 | 0.5 |
| 51 | MOL011169 | Peroxyergosterol | 44.39 | 0.8 |