科华智慧（深圳）创新药物研发有限公司-天然产物化合物库-创新药物研发-波谱智能解析-化合物冷冻电镜结构解析

天然产物数据库

您可快速检索70万⁺天然产物信息

检索最多: 白僵菌素大品种冬虫夏草人参三七党参大戟决明半夏丁香

CAS No.	英文名/中文名/SMILES	分子式	分子量
-	(2S)-2-[[(3S)-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]-3-phenylpropanoic acid - COC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O	C₂₁H₂₂N₂O₅	382.4
-	methyl 3-[(2S)-18-(3-methoxy-3-oxopropyl)-3,3,7,12,17-pentamethyl-2H-porphyrin-2-yl]propanoate - CC1=CC2=CC3=NC(=CC4=NC(=CC5=NC(=CC1=N2)C=C5C)C([C@@H]4CCC(=O)OC)(C)C)C(=C3C)CCC(=O)OC	C₃₃H₃₆N₄O₄	552.7
-	3-(3,4-dimethoxyphenyl)-5-[(1S)-1-hydroxyethyl]-1,2-oxazole-4-carboxylic acid - C[C@@H](C1=C(C(=NO1)C2=CC(=C(C=C2)OC)OC)C(=O)O)O	C₁₄H₁₅NO₆	293.27
-	(1S,5S,6R,13R,21S)-5,13-bis(4-hydroxyphenyl)-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-9,17,19,21-tetrol - C1[C@H]([C@@H](OC2=C1C(=CC3=C2[C@H]4[C@@H]([C@@](O3)(OC5=CC(=CC(=C45)O)O)C6=CC=C(C=C6)O)O)O)C7=CC=C(C=C7)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O	C₃₆H₃₄O₁₅	706.6
-	(3S,4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4R,5S,6R)-3-acetamido-6-[[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxy-3,5-dihydroxy-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)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@]5([C@@H]4CC=C6[C@]5(C[C@H]([C@@]7([C@H]6CC([C@H](C7)O)(C)C)C(=O)O)O)C)C)C)NC(=O)C)O)O)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)O)O	C₄₉H₇₉NO₁₈	970.1
-	N-[2-(1H-indol-3-yl)ethyl]-3-(pyridin-3-yl)-1H-pyrazole-5-carboxamide - C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CC(=NN3)C4=CN=CC=C4	C₁₉H₁₇N₅O	331.4
-	1-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyphenyl)ethyl]-9H-beta-carboline-3-carboxamide - COC1=CC=C(C=C1)CCNC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC6=C(C=C5)OCO6	C₂₈H₂₃N₃O₄	465.5
263364-89-2	7-Ethoxy-3-(4-methoxyphenyl)-4-phenylchromen-2-one - CCOC1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=C(C=C3)OC)C4=CC=CC=C4	C₂₄H₂₀O₄	372.4
-	2-(4-methoxyphenyl)-N-(2,4,5-trichlorophenyl)acetamide - COC1=CC=C(C=C1)CC(=O)NC2=CC(=C(C=C2Cl)Cl)Cl	C₁₅H₁₂Cl₃NO₂	344.6
-	(4aS,8aS)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,8a-dihydrochromen-4-one - C1=CC(=C(C=C1C2=C(C(=O)[C@H]3[C@@H](O2)C=C(C=C3O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O	C₂₁H₂₂O₁₂	466.4