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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	5-methyl-2-[(1R,2R,4R,6S)-5,5,6-trimethyl-2-bicyclo[2.2.1]heptanyl]phenol - C[C@H]1[C@H]2C[C@@H](C1(C)C)C[C@H]2C3=C(C=C(C=C3)C)O	C₁₇H₂₄O	244.37
-	Boc-Tyr(Boc)-Ala-Gly-Val-OMe - C[C@@H](C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)OC)NC(=O)[C@H](CC1=CC=C(C=C1)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C	C₃₀H₄₆N₄O₁₀	622.7
-	ethyl (3R,4S,6S)-4,6-diphenylpiperidine-3-carboxylate - CCOC(=O)[C@H]1CN[C@@H](C[C@@H]1C2=CC=CC=C2)C3=CC=CC=C3	C₂₀H₂₃NO₂	309.4
-	(2R)-2-[(2,2-diphenylacetyl)amino]-3-(1H-indol-3-yl)-N-(4-iodophenyl)propanamide - C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)NC5=CC=C(C=C5)I	C₃₁H₂₆IN₃O₂	599.5
-	(2S,5aS,8aR)-2-[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]-1-methyl-6-(thiadiazol-4-ylmethyl)-3,4,5a,7,8,8a-hexahydro-2H-pyrrolo[3,2-e][1,4]diazepin-5-one - CN1[C@@H]2CCN([C@@H]2C(=O)NC[C@@H]1CCC(=O)N3CCC4=CC=CC=C43)CC5=CSN=N5	C₂₂H₂₈N₆O₂S	440.6
-	(3S,8S,9S,10S,13R,14S,17R)-17-[(E,2R,5S)-5,6-dimethylhept-3-en-2-yl]-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol - C[C@H](/C=C/[C@@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)CO)C	C₂₈H₄₆O₂	414.7
-	(3S,5R,6R,10R,13R,17R)-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol - CC(C)CCCC(C)[C@H]1CCC2[C@@]1(CCC3C2=C[C@H]([C@@]4([C@@]3(CC[C@@H](C4)O)C)O)O)C	C₂₇H₄₆O₃	418.7
-	[(1S,2S,3R,4R,5R,6R)-2,5-dihydroxy-3-[(E)-2-(hydroxymethyl)but-2-enoyl]oxy-6-(2-methylbutanoyloxy)-4-[(E)-2-methylbut-2-enoyl]oxycyclohexyl] (E)-2-(hydroxymethyl)but-2-enoate - CCC(C)C(=O)O[C@@H]1[C@H]([C@H]([C@@H]([C@H]([C@@H]1OC(=O)/C(=C/C)/CO)O)OC(=O)/C(=C/C)/CO)OC(=O)/C(=C/C)/C)O	C₂₆H₃₈O₁₂	542.6
-	cyclo[DL-OLeu-DL-N(Me)Val-DL-OLeu-DL-N(Me)Val-DL-OLeu-DL-N(Me)Val] - CC(C)CC1C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)O1)C(C)C)C)CC(C)C)C(C)C)C)CC(C)C)C(C)C)C	C₃₆H₆₃N₃O₉	681.9
-	(1S,17S,22S,24R)-24-[(1S,5S)-1,5-dimethylcyclohex-2-en-1-yl]-17-ethyl-19,20-dithiatetracyclo[20.3.1.13,7.09,14]heptacosa-3,5,7(27),9,11,13-hexaen-5-ol - CC[C@H]1CCC2=CC=CC=C2CC3=CC(=CC(=C3)O)C[C@@H]4C[C@@H](C[C@@H](C4)[C@@]5(C[C@H](CC=C5)C)C)CSSC1	C₃₅H₄₈OS₂	548.9