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CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aS,13bS)-3a-[(Z)-hydroxyiminomethyl]-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol - CC(=C)[C@@H]1CC[C@@]2([C@@H]1[C@@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)/C=N\O	C₃₀H₄₉NO₂	455.7
-	(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenyl-N,N-dipropylpropanamide - CCCN(CCC)C(=O)C[C@H]([C@H]1CCOC(C1)(C)C)C2=CC=CC=C2	C₂₂H₃₅NO₂	345.5
-	(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4R,5S,6S)-4-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid - C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O)O)O	C₅₂H₈₄O₂₀	1029.2
-	(3R,6S,9S,12R,15S,18R,21S,24S,33S)-30-ethyl-1,4,7,10,12,15,19,25,28-nonamethyl-33-[(E,2R)-2-methylhex-4-enyl]-6,9,18,24-tetrakis(2-methylpropyl)-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone - CCC1C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N([C@H](C(=O)N1)C[C@H](C)C/C=C/C)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C	C₆₂H₁₁₁N₁₁O₁₁	1186.6
-	H-DL-Ala-DL-Pro-DL-Ala-DL-Phe-DL-Ser-DL-Val-DL-Ser-DL-Pro-DL-Ala-DL-Ser-OH - CC(C)C(C(=O)NC(CO)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(CO)C(=O)O)NC(=O)C(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C)NC(=O)C3CCCN3C(=O)C(C)N	C₄₂H₆₄N₁₀O₁₄	933.0
-	(1R,7R,9S,10R)-4-[3-[(6S)-2-amino-1,4,5,6-tetrahydropyrimidin-6-yl]propyl]-9-(hydroxymethyl)-10,11,11-trimethyltricyclo[5.3.1.01,5]undec-4-en-3-one - C[C@@H]1[C@H](C[C@@H]2CC3=C(C(=O)C[C@]13C2(C)C)CCC[C@H]4CCN=C(N4)N)CO	C₂₂H₃₅N₃O₂	373.5
-	2-[[1-[2-[[2-[[2-(Dimethylamino)-3-[8-hydroxy-4-methoxy-12,15-dimethyl-11,14-dioxo-13-propan-2-yl-9-(pyrrolidine-2-carbonylamino)-2-oxa-12,15-diazatricyclo[16.2.2.13,7]tricosa-1(20),3,5,7(23),16,18,21-heptaene-16-carbonyl]oxybutanoyl]amino]-3-methylbutanoyl]amino]-2-phenylacetyl]pyrrolidine-2-carbonyl]-methylamino]-3-methylbutanoic acid - CC(C)C1C(=O)N(C(=CC2=CC=C(C=C2)OC3=C(C=CC(=C3)C(C(CC(=O)N1C)NC(=O)C4CCCN4)O)OC)C(=O)OC(C)C(C(=O)NC(C(C)C)C(=O)NC(C5=CC=CC=C5)C(=O)N6CCCC6C(=O)N(C)C(C(C)C)C(=O)O)N(C)C)C	C₆₂H₈₅N₉O₁₄	1180.4
-	1'-benzoyl-2-methyl-4-(pyridin-4-ylmethyl)spiro[6H-pyrazolo[1,5-a]pyrimidine-7,4'-piperidine]-5-one - CC1=NN2C(=C1)N(C(=O)CC23CCN(CC3)C(=O)C4=CC=CC=C4)CC5=CC=NC=C5	C₂₄H₂₅N₅O₂	415.5
-	(1R,2R,3R,6S,8S,10R,11R,12R)-11,12-dihydroxy-3,8-dimethyl-5,9,15-trioxatetracyclo[11.2.1.02,6.08,10]hexadec-13(16)-ene-4,14-dione - C[C@@H]1[C@@H]2[C@H](C[C@]3([C@H](O3)[C@@H]([C@@H](C4=C[C@H]2OC4=O)O)O)C)OC1=O	C₁₅H₁₈O₇	310.30
-	(6S,7S)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid - CC1=NN=C(S1)SCC2=C(N3[C@H]([C@H](C3=O)NC(=O)CN4C=NN=N4)SC2)C(=O)O	C₁₄H₁₄N₈O₄S₃	454.5